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3-hexenyl phenylacetate
Notes:
Boosting effect in mint. Flavouring ingredient. Present in Mentha spp.
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Bedoukian Research, Inc. Constantly Improving Working closely with our customers to meet their requirements. Paul Bedoukian founded the company to fill a niche as a supplier of high quality specialty aroma and flavor ingredients. In 1975 the company began manufacturing insect pheromones which are chemically similar to flavor and fragrance ingredients. Today, Bedoukian Research offers more than 450 Aroma Chemicals and 50 Insect Pheromones, while also providing custom manufacturing services to the pharmaceutical, agrochemical, and specialty chemical industries. US Email: Customer Service US Voice: 1-203-830-4000 US Fax: 1-203-830-4010 News Products List: View Product(s): 112 cis-3-HEXENYL PHENYLACETATE ≥98.0% (cis), Kosher SDS Has a boosting effect in mint fragrances. Also used for subtle honey and rose notes
Finds use in honey, pear, cabbage and onion flavors.
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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: 1-631-504-6093 Fax: 1-631-614-7828 US Voice: 1-631-504-6093 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 42436-07-7 cis-3-HEXENYL PHENYLACETATE 99.0% (sum of isomers)
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FCI SAS Inspired by Nature At FCI customer service is not a department it’s an attitude. Our team is composed of motivated professionals with great experience in the flavours and fragrances market. Our company has been serving this industry for more than 40 years and is ISO 9001 certified since 2009 . Whatever your question on flavour and fragrance ingredients: commercial, technical or regulatory – we will answer it very quickly. Email: Info Email: Philippe Faucher US Email: USA Sales Email: Germany Sales Email: Italy Sales Email: Japan Sales Voice: +33 (0)1 34 25 58 10 Fax: + 33 1 34 25 58 18 About Us Product(s): 12237 CIS-3-HEXENYL PHENYL ACETATE
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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): 08-35000 CIS-3-HEXENYL PHENYLACETATE
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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): W363308 cis-3-Hexenyl phenylacetate, ≥98%, stabilized, FG SDS
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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): P1044 cis-3-Hexen-1-yl Phenylacetate >95.0%(GC)
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| CAS Number: | 42436-07-7 |  3D/inchi
|
| % from: | 98.00% to 99.90% | |
| ECHA EINECS - REACH Pre-Reg: | 255-826-6 | |
| FDA UNII: | 8XZ0MZ4575 | |
| Nikkaji Web: | J73.248F | |
| Beilstein Number: | 3266406 | |
| MDL: | MFCD00036531 | |
| CoE Number: | 10682 | |
| XlogP3: | 3.70 (est) | |
| Molecular Weight: | 218.29586000 | |
| Formula: | C14 H18 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
| Also(can) Contains: | (E)-3-hexen-1-yl phenyl acetate | |
| EFSA/JECFA Comments: | According to JECFA: Min. assay value is "97 %" and "predominantly (>90 %) cis-isomer". | |
Category: flavor and fragrance 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 |
| JECFA Food Flavoring: | 1016 3-hexenyl phenylacetate |
| DG SANTE Food Flavourings: | 09.805 3-hexenyl phenylacetate |
| FEMA Number: | 3633 3-hexenyl phenylacetate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 42436-07-7 ; 3-HEXENYL PHENYLACETATE |
| FDA Regulation: | |
| FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants. | |
Physical Properties:
Organoleptic Properties:
| Odor Type: green | |
| Odor Strength: | medium |
| Substantivity: | 171 hour(s) at 100.00 % |
| green rose honey waxy sweet pea tropical kiwi beany | |
| Odor Description: at 100.00 %. | green rose honey waxy sweet pea tropical kiwi beany Luebke, William tgsc, (2009) |
| green floral vegetable tropical melon | |
| Odor Description: | Green, floral, vegetable, tropical and melon-like nuances Mosciano, Gerard P&F 16, No. 2, 49, (1991) |
| Flavor Type: green | |
| waxy green floral vegetable melon | |
| Taste Description: at 15.00 ppm. | Waxy, green, floral with vegetable and melon nuances Mosciano, Gerard P&F 16, No. 2, 49, (1991) |
| Odor and/or flavor descriptions from others (if found). | |
| Bedoukian Research | |
| cis-3-HEXENYL PHENYLACETATE ≥98.0% (cis), Kosher | |
| Odor Description: | Floral, honey, green Has a boosting effect in mint fragrances. Also used for subtle honey and rose notes |
| Taste Description: | waxy green Finds use in honey, pear, cabbage and onion flavors. |
| Kingchem Laboratories | |
| C3 HEXENYL PHENYL ACETATE | |
| Odor Description: | Sweet green-rosy odor, woody undertone |
| FCI SAS | |
| CIS-3-HEXENYL PHENYL ACETATE | |
| Odor Description: | Sweet green-rosy odor with a woody undertone |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
Safety Information:
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| None - None found. | |
|
S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 36 - Wear suitable protective clothing. | |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
|
oral-rat LD50 > 5000 mg/kg (Moreno, 1976n) oral-rat LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 17, Pg. 803, 1979. | |
| Dermal Toxicity: | |
|
skin-rabbit LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 17, Pg. 803, 1979. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for (Z)-3-hexen-1-yl phenyl acetate usage levels up to: | |||
| 12.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.73 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 0.05 (μg/capita/day) | ||
| Structure Class: | I | ||
| 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: 12 | |||
| Click here to view publication 12 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 8.80000 | |
| beverages(nonalcoholic): | - | 7.80000 | |
| beverages(alcoholic): | - | 5.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 7.80000 | |
| fruit ices: | - | - | |
| gelatins / puddings: | - | 8.80000 | |
| 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: | - | 8.80000 | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
Safety References:
| Flavor & Extract Manufacturers Association (FEMA) reference(s): | |
| The FEMA GRAS assessment of phenethyl alcohol, aldehydes, acids, and related acetals and esters used as flavor ingredients. View pdf | |
| 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): | |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to: Flavouring Group Evaluation 14 (FGE.14): Phenethyl alcohol, aldehyde, esters, and related phenylacetic acid esters from chemical group 15 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf | |
| Flavouring Group Evaluation 53 (FGE.53): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and one phenoxyethyl ester evaluated in FGE.23 (2006) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf | |
| Flavouring Group Evaluation 14, Revision 1 (FGE.14Rev1): Phenethyl alcohol, aldehyde, acetals, carboxylic acid and related esters from chemical group 15 and 22 [1] - 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 53, Revision 1 (FGE.53Rev1): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) FGE.23Rev1 (2008) View page or View pdf | |
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 42436-07-7 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5367698 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| [(Z)-hex-3-enyl] 2-phenylacetate | |
| Chemidplus: | 0042436077 |
| RTECS: | CY1630000 for cas# 42436-07-7 |
References:
| [(Z)-hex-3-enyl] 2-phenylacetate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 42436-07-7 |
| Pubchem (cid): | 5367698 |
| Pubchem (sid): | 135021584 |
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 |
| HMDB (The Human Metabolome Database): | HMDB38281 |
| FooDB: | FDB017579 |
| Export Tariff Code: | 2916.39.7700 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| apple | FR | |
| cabbage | FL | |
| cucumber | FR | |
| floral | FR | |
| green | FR | |
| honey | FR | |
| honeysuckle | FR | |
| melon | FR | |
| mint | FR | |
| onion | FL | |
| pear | FR | |
| rose | FR | |
| vegetable | FL |
Occurrence (nature, food, other): note
| cornmint oil Search Trop Picture | |
| linden flower Search Trop Picture | |
| peppermint oil Search Trop Picture | |
| spearmint oil scotch Search Trop Picture | |
| tea Search Trop Picture |
Synonyms:
| benzene acetic acid (3Z)-3-hexen-1-yl ester | |
| (Z)- | benzene acetic acid 3-hexen-1-yl ester |
| benzeneacetic acid, (3Z)-3-hexen-1-yl ester | |
| benzeneacetic acid, (3Z)-3-hexenyl ester | |
| benzeneacetic acid, 3-hexenyl ester, (Z)- | |
| (3Z)- | hex-3-en-1-yl phenylacetate |
| (Z)- | hex-3-enyl phenyl acetate |
| cis- | hex-3-enyl phenyl acetate |
| (Z)- | hex-3-enyl phenylacetate |
| [(Z)- | hex-3-enyl] 2-phenylacetate |
| 3- | hexen-1-yl alpha-toluate |
| beta,gamma- | hexen-1-yl alpha-toluate |
| (Z)-3- | hexen-1-yl benzene acetate |
| (Z)-3- | hexen-1-yl phenyl acetate |
| 3- | hexen-1-yl phenyl acetate |
| cis-3- | hexen-1-yl phenyl acetate |
| cis-3- | hexen-1-yl phenylacetate |
| 3- | hexenyl benzeneacetate, (Z)- |
| 3- | hexenyl benzeneacetate, cis- |
| (Z)-3- | hexenyl phenyl acetate |
| C3 | hexenyl phenyl acetate |
| cis-3- | hexenyl phenyl acetate |
| (Z)-3- | hexenyl phenylacetate |
| cis-3- | hexenyl phenylacetate |
| phenylacetic acid cis-3-hexen-1-yl ester |