Articles:
| Info: | miscellaneous nitrogen derivatives |
3-methylthiopropyl isothiocyanate
Notes:
Found in hydrolysates of crucifer seeds. Also found in cabbage, cauliflower, kohlrabi, horse radish (Armoracia lapathifolia), Japanese horseradish (Wasabi japonica) and radish (Rapharius sativus). Flavouring ingredient
-
Advanced Biotech. Inc. Inspired by Nature A diverse range of products, all meeting our stringent commitment to quality. Advanced Biotech is a leading manufacturer and supplier of high-quality Natural flavoring ingredients & botanical extracts for the food/beverage, cosmetic and personal care industries. With over 25 years of experience working with Fermentation processing & botanical extracts, we can help develop new innovative and functional products for today’s competitive marketplace. Our company prides itself in the ability to cater to our customer’s specific needs while maintaining our focus on integrity, honesty and the commitment to high quality product standards. We proudly offer our quality Natural ingredients to companies around the world. US Email: Info US Email: Quotes and Orders US Voice: 973-339-6242 US Fax: 973-256-4101 Facebook Twitter Instagram Linkedin Pinterest Upcoming Events Blog Vimeo Product(s): 4087 3-(METHYLTHIO) PROPYL ISOTHIOCYANATE SDS
-
-
BOC Sciences Best of Chemicals Supplier Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds. BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services. BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies. Email: Marketing US Email: Marketing Email: Sales US Email: Sales Voice: 1-631-485-4226 Fax: 1-631-614-7828 US Voice: 1-631-485-4226 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 505-79-3 Iberverin, 97%
-
-
Endeavour Specialty Chemicals Ltd Expertise in high impact aroma chemicals Endeavour Speciality Chemicals offers high-impact aroma chemicals, at small to medium scale. Speciality Chemical has more than 25 years experience of manufacturing high-impact aroma chemicals. With our core expertise in sulfur and heterocyclic chemistries, Endeavours products have applications in a range of industry sectors including flavours and fragrances, pharmaceutical research and material sciences. Endeavour also offer custom synthesis and contract manufacturing services at their UK manufacturing site. Email: Info Email: Sales Voice: +44 (0)1327 310 079 Fax: +44 (0)1327 310 701 Twitter Linkedin News Speciality Chemical Product Groups Product(s): AT0140 3-(Methylthio)propyl isothiocyanate 98% F&F
-
-
M&U International LLC Steady supply & demand Meeting customers increasing demands at home as well as abroad. M&U dedicates itself to the development and production of new products as well as continuously promoting those new products. We’ve maintained a steady supply&demand relationship with a large number of manufacturers at home and abroad. We’ve developed an extensive network and because of our relationships with these manufacturers, we’re able to provide a stable supply of great quality materials. We’re located in China’s largest communications hub, Shanghai and in the U.S. near one of the largest sea ports on the East Coast. The strategic locations of our facilities ensure convenient, prompt and secure delivery of our products to our customers. Email: Sales US Email: Sales Voice: +86-21-32515501 60762991 60762992 Fax: +86-21-32515502 64204960 US Voice: 908-359-9000 US Fax: 908-359-9002 News Product(s): A0320 3-(METHYLTHIO)PROPYL ISOTHIOCYANATE, Kosher
-
-
Penta International Corporation Chemistry innovation At Penta, our products and services help businesses do business better. For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes. US Email: Technical Services US Email: Sales US Voice: (973) 740-2300 US Fax: (973) 740-1839 Product(s): 13-72500 3-METHYLTHIOPROPYL ISOTHIOCYANATE
-
-
Robinson Brothers Limited Providing Excellence in Chemistry Award-winning UK chemical manufacturer of chemical intermediates and high-impact aroma chemicals. Based in the UK, Robinson Brothers is an award-winning chemical manufacturer of chemical intermediates and high-impact aroma chemicals. Robinson Brothers serve many industry sectors across the globe, include: flavour/fragrance, pharmaceutical, agrochemical and material sciences. Our team of Chemists are experts in custom synthesis, contract manufacture and process optimisation. Email: Info Email: Sales Voice: +44 (0)121 553 2451 Fax: +44 (0)121 500 5183 Twitter Linkedin News And Exhibitions Custom Synthesis Industries And Applications https://www.robinsonbrothers.uk/chemistry-competences Products List: View Product(s): AT0140 3-(Methylthio)propyl Isothiocyanate F&F
-
-
Sigma-Aldrich Complete Supply Chain The perfect blend of products and services that bring your creativity to life. Sigma-Aldrich is a leading Life Science and High Technology company dedicated to providing high-quality, safe and certified flavor ingredients with transparent and easily accessible documentation to customers around the globe. Sigma-Aldrich also provides a suite of analytical tools that allow food analysts to simplify sample preparation, cleanup and analysis steps, while increasing sensitivity to trace ingredients and harmful substances to meet regulations and quality standards. Email: Information US Email: Sales US Voice: 800-244-1173 US Fax: 800-368-4661 Facebook Twitter Instagram Linkedin Flavors and Fragrances Analysis FandF Newsletter Subscription Flavors and Fragrances Learning Center Certified Food Grade Products Product(s): W331201 3-(Methylthio)propyl isothiocyanate, ≥98%, FG SDS
-
-
Synerzine, Inc. Innovation. Customization. Aroma Ingredients. Synerzine is a leading supplier of flavor and fragrance ingredients. Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust. Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster. US Email: Customer Service US Email: Sales US Voice: (404) 524-6744 US Fax: (404) 577-1651 Inquiry Products List: View Product(s): W1859 3-Methylthiopropyl Isothiocyanate
-
-
TCI AMERICA Moving Your Chemistry Forward We continuously strive to advance our technology. With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping! Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis. US Email: Sales Email: Technical Support Voice: 1-800-423-8616 Fax: 1- 888-520-1075 Facebook Twitter Instagram Linkedin Product(s): M2027 3-(Methylthio)propyl Isothiocyanate >97.0%(GC)
-
-
R C Treatt and Co Ltd Innovative ingredient solutions World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries. We offer innovative and trend-setting product concepts for our customers, collaborating with them to create true value for their products. Email: Enquiries US Email: Enquiries Voice: +44 (0) 1284 702500 Fax: +44 (0) 1284 703809 US Voice: +1 863 668 9500 US Fax: +1 863 668 3388 Twitter Linkedin Youtube News Product(s): 3-Methylthiopropyl isothiocyanate Halal, Kosher
Used in radish, mustard and condiment flavours. This material and allyl isothiocyanate are both constituents in horseradish and are the only two characterising materials on the GRAS list permitted for such flavors. In nature, Allyl isothiocyanate and 2-phenethyl isothiocyanate constitute 37% and 27% of horseradish volatiles, respectively; this material being a relatively minor constituent (e.g. about 1%). Normal use levels in finished consumer product: 0.05-5 ppm. Council of Europe limits: Foods (5 ppm).
-
-
Qingdao Free Trade Zone United International Co Ltd Quality Products A partner in your supply chain solution. Qingdao Free Trade Zone United International Trade Co., Ltd.was founded in 1996, specializing in the production and import and export of food additives,flavor raw materials and pharmaceutical and chemical raw materials. The company has experienced R&D and business personnel,product quality, low price, efficient service and fast insight and grasp the latest market information. Email: Info Email: Sales Voice: +86-532-83893699 Fax: +86-532-83893695 Product(s): 9060 3-Methylthio Propyl Isothiocyanate
-
| CAS Number: | 505-79-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 208-020-3 | |
| FDA UNII: | YTT13BN94Z | |
| Nikkaji Web: | J182.259D | |
| MDL: | MFCD00209521 | |
| CoE Number: | 2326 | |
| XlogP3-AA: | 2.60 (est) | |
| Molecular Weight: | 147.26373000 | |
| Formula: | C5 H9 N S2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavoring agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 1564 3-methylthiopropyl isothiocyanate |
| DG SANTE Food Flavourings: | 12.030 3-(methylthio)propyl isothiocyanate |
| FEMA Number: | 3312 3-methylthiopropyl isothiocyanate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 505-79-3 ; 3-METHYLTHIOPROPYL ISOTHIOCYANATE |
Physical Properties:
| Appearance: | colorless to yellow clear liquid (est) |
| Assay: | 98.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 254.00 °C. @ 760.00 mm Hg |
| Acid Value: | 1.00 max. KOH/g |
| Vapor Pressure: | 0.045000 mmHg @ 25.00 °C. (est) |
| Flash Point: | > 230.00 °F. TCC ( > 110.00 °C. ) |
| logP (o/w): | 2.349 (est) |
| Soluble in: | |
| alcohol | |
| water, 739.9 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Similar Items: note | |
| allyl isothiocyanate | |
| amyl isothiocyanate | |
| isoamyl isothiocyanate | |
| benzyl isothiocyanate | |
| 3-buten-1-yl isothiocyanate | |
| butyl isothiocyanate | |
| isobutyl isothiocyanate | |
| sec-butyl isothiocyanate | |
| ethyl isothiocyanate | |
| 5-hexen-1-yl isothiocyanate | |
| hexyl isothiocyanate | |
| methyl isothiocyanate | |
| 4-methyl thiobutyl isothiocyanate | |
| 6-methyl thiohexyl isothiocyanate | |
| 5-methyl thiopentyl isothiocyanate | |
| 4-pentenyl isothiocyanate | |
| 2-phenethyl isothiocyanate | |
| isopropyl isothiocyanate | |
Organoleptic Properties:
| Odor Type: rooty | |
| earthy vegetable sulfurous horseradish radish rooty metallic | |
| Odor Description: at 0.01 % in propylene glycol. | earthy vegetable sulfurous horseradish |
| rooty pungent vegetable sulfurous horseradish | |
| Odor Description: | Rooty, pungent, vegetative, sulfureous and horseradish-like Mosciano, Gerard P&F 18, No. 3, 53, (1993) |
| Flavor Type: vegetable | |
| vegetable radish sulfurous earthy metallic | |
| Taste Description: at 5.00 ppm. | Vegetative, radish-Iike with sulfureous, earthy and metallic nuances Mosciano, Gerard P&F 18, No. 3, 53, (1993) |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Advanced Biotech |
| 3-(METHYLTHIO) PROPYL ISOTHIOCYANATE |
| BOC Sciences |
| For experimental / research use only. |
| Iberverin, 97% |
| DeLong Chemicals America |
| 3-Methylthiopropyl isothiocyanate, Kosher |
| Endeavour Specialty Chemicals |
| 3-(Methylthio)propyl isothiocyanate 98% F&F |
| Speciality Chemical Product Groups |
| Kingchem Laboratories |
| 3 METHYL THIOPROPYL ISOTHIOCYANATE
Odor: Radish |
| M&U International |
| 3-(METHYLTHIO)PROPYL ISOTHIOCYANATE, Kosher |
| Penta International |
| 3-METHYLTHIOPROPYL ISOTHIOCYANATE |
| R C Treatt & Co Ltd |
| 3-Methylthiopropyl isothiocyanate
Halal, Kosher Odor: rooty, pungent, vegetative, sulphurous and horseradish-like Flavor: Vegetative, radish-like with sulphurous, earthy and metallic nuances at 5 ppm Used in radish, mustard and condiment flavours. This material and allyl isothiocyanate are both constituents in horseradish and are the only two characterising materials on the GRAS list permitted for such flavors. In nature, Allyl isothiocyanate and 2-phenethyl isothiocyanate constitute 37% and 27% of horseradish volatiles, respectively; this material being a relatively minor constituent (e.g. about 1%). Normal use levels in finished consumer product: 0.05-5 ppm. Council of Europe limits: Foods (5 ppm). |
| Robinson Brothers |
| 3-(Methylthio)propyl Isothiocyanate F&F |
| https://www.robinsonbrothers.uk/chemistry-competences |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Iberverin ≥97% |
| Sigma-Aldrich |
| 3-(Methylthio)propyl isothiocyanate, ≥98%, FG
Odor: alliaceous (onion, garlic); vegetable |
| Certified Food Grade Products |
| Synerzine |
| 3-Methylthiopropyl Isothiocyanate |
| TCI AMERICA |
| For experimental / research use only. |
| 3-(Methylthio)propyl Isothiocyanate >97.0%(GC) |
| United International |
| 3-Methylthio Propyl Isothiocyanate |
Safety Information:
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 23 - Do not breath vapour. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| Skin irritation (Category 2), H315 Eye irritation (Category 2A), H319 | |
| GHS Label elements, including precautionary statements | |
| Pictogram |  |
| Signal word | Warning |
| Hazard statement(s) | |
| H315 - Causes skin irritation H319 - Causes serious eye irritation | |
| Precautionary statement(s) | |
| P264 - Wash skin thouroughly after handling. P280 - Wear protective gloves/protective clothing/eye protection/face protection. P302 + P352 - IF ON SKIN: wash with plenty of soap and water. P305 + P351 + P338 - IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P332 + P313 - IF SKIN irritation occurs: Get medical advice/attention. P337 + P313 - IF eye irritation persists: Get medical advice/attention. P362 - Take off contaminated clothing and wash before reuse. | |
| Oral/Parenteral Toxicity: | |
|
oral-rat LD50 [sex: M,F] 540 mg/kg (Harper & Ginn, 1964) | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavoring agents | ||
| Recommendation for radish isothiocyanate usage levels up to: | |||
| not for fragrance use. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 11.10 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 52.00 (μg/capita/day) | ||
| Threshold of Concern: | 540 (μg/person/day) | ||
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). | |||
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library | |||
| publication number: 5 | |||
| Click here to view publication 5 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | - | |
| beverages(nonalcoholic): | - | - | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | 4.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | - | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | - | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): | |
| Flavouring Group Evaluation 85: Consideration of miscellaneous nitrogen-containing substances evaluated by JECFA (65th meeting)[1] - Scientific Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf | |
| Flavouring Group Evaluation 38 (FGE.38)[1] 3-Butenyl isothiocyanate - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 505-79-3 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 62351 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| 1-isothiocyanato-3-methylsulfanylpropane | |
| Chemidplus: | 0000505793 |
References:
| 1-isothiocyanato-3-methylsulfanylpropane | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 505-79-3 |
| Pubchem (cid): | 62351 |
| Pubchem (sid): | 135019889 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Substances Added to Food (formerly EAFUS): | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB34370 |
| FooDB: | FDB012744 |
| Export Tariff Code: | 2929.10.8090 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| cabbage | FL | |
| garlic | FL | |
| horseradish | FL | |
| leek | FL | |
| mustard | FL | |
| onion | FL | |
| radish | FL |
Occurrence (nature, food, other): note
| cabbage leaf Search Trop Picture | |
| cauliflower Search Trop Picture | |
| crucifer seed Search PMC Picture | |
| horseradish root Search Trop Picture | |
| iberis sempervirens seed Search Trop Picture | |
| kohlrabi stem Search Trop Picture | |
| radish Search Trop Picture | |
| wasabi Search Trop Picture |
Synonyms:
| 3- | methyl mercaptopropyl isothiocyanate |
| 3-( | methyl thio) propyl isothiocyanate |
| 3- | methyl thiopropyl isothiocyanate |
| 3 | methyl thiopropyl isothiocyanate |
| methyl-3 thiopropyl isothiocyanate | |
| 3-( | methylmercapto)propyl isothiocyanate |
| 3- | methylmercaptopropyl isothiocyanate |
| 3-( | methylthio) propyl isothiocyanate |
| 3-( | methylthio)propyl isothiocyanate |
| 3-( | methylthio)propylisothiocyanate |
| 3- | methylthiopropanisothiocyanate |
| 3- | methylthiopropyl isothiocyanate |
| propane, 1-isothiocyanato-3-(methylthio)- | |
| 3- | propylisothiocyanate |
| 1-iso | thiocyanato-3-(methyl thio) propane |
| 1-iso | thiocyanato-3-(methylsulfanyl)propane |
| 1-iso | thiocyanato-3-(methylthio)propane |
| 1-iso | thiocyanato-3-methylsulfanylpropane |
| iso | thiocyanic acid 3-(methyl thio) propyl ester |
| iso | thiocyanic acid 3-(methylthio)propyl ester |
| iso | thiocyanic acid, 3-(methylthio)propyl ester |