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isovaleric acid linalyl ester
Notes:
Used in perfumery and food flavouring. Present in Salvia spp. e.g. sage (Salvia officinalis)
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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: 1-631-485-4226 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): 1118-27-0 Linalyl Isovalerate
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Bontoux SAS Major international supplier Major international Producer of aromatic ingredients for the production of fragrances, flavors, cosmetics, pharmaceuticals and Aromatherapy. Bontoux Inc. was established in 1993 to directly service our North American clientele. The facility primarily serves as a Sales Customer Service, Repacking and Distribution Center for our customers in North America. Email: Information US Email: Information Email: Sales US Email: Sales Voice: + 33.(0)4.75.28.64.64 Fax: + 33.(0)4.75.28.60.32 US Voice: + 1.908.755.4800 US Fax: + 1.908.755.4844 Facebook Instagram Linkedin Product(s): LINALYLE ISOVALERATE
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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): 12-62000 LINALYL ISOVALERATE
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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): W264601 Linalyl isovalerate, ≥95%, FG SDS
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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): W127 Linalyl Isovalerate
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WholeChem, LLC Connecting Innovators To the Building Blocks Of the Universe Custom manufacturer and distributor of specialty ingredients. We make global local. SQF-Certified Supplier We owe our success to our integrity, our dedication to the industry, and our commitment to our clients. We invite your inquiries regarding our current product list and any other products you may be having trouble sourcing. Email: Info Email: Orders Voice: +1 (262) 995.8668 Certification Our Services Products List: View Product(s): Linalyl Isovalerate
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| CAS Number: | 1118-27-0 |  3D/inchi
|
| Other(deleted CASRN): | 50649-12-2 | |
| ECHA EINECS - REACH Pre-Reg: | 214-259-4 | |
| FDA UNII: | 1X8S4K3UQ9 | |
| Nikkaji Web: | J34.608J | |
| MDL: | MFCD00048304 | |
| CoE Number: | 449 | |
| XlogP3-AA: | 4.80 (est) | |
| Molecular Weight: | 238.37062000 | |
| Formula: | C15 H26 O2 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
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 |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 363 linalyl isovalerate |
| DG SANTE Food Flavourings: | 09.454 linalyl isovalerate |
| FEMA Number: | 2646 linalyl isovalerate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 1118-27-0 ; LINALYL ISOVALERATE |
| 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: herbal | |
| citrus bergamot lavender peach apricot sage | |
| Odor Description: at 100.00 %. | citrus bergamot lavender peach apricot sage |
| Flavor Type: fruity | |
| fruity apple plum peach | |
| Taste Description: | sweet fruity apple plum peach |
| Odor and/or flavor descriptions from others (if found). | |
| Kingchem Laboratories | |
| LINALYL ISOVALERATE | |
| Odor Description: | Stable, suave, fruity |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Linalyl Isovalerate |
| Bontoux |
| LINALYLE ISOVALERATE |
| Inoue Perfumery |
| LINALYL ISOVALERATE |
| Kingchem Laboratories |
| LINALYL ISOVALERATE
Odor: Stable, suave, fruity |
| Nagar Haveli Perfumes & Aromatics |
| Linalyl Isovalerate
Odor: Citrus bergamot lavender peach apricot sage |
| Penta International |
| LINALYL ISOVALERATE |
| Reincke & Fichtner |
| Linalyl Isovalerate |
| Sigma-Aldrich |
| Linalyl isovalerate, ≥95%, FG
Odor: apple; fruity; sage; sweet |
| Certified Food Grade Products |
| Synerzine |
| Linalyl Isovalerate |
| WholeChem |
| Linalyl Isovalerate |
Safety Information:
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. 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 - 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, 1975l) oral-mouse LD50 [sex: M,F] 25165 (Hoffman-LaRoche, Inc., 1967b) | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for linalyl isovalerate usage levels up to: | |||
| 4.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 4.60 (μg/capita/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: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 5.60000 | |
| beverages(nonalcoholic): | - | 0.96000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 0.91000 | |
| fruit ices: | - | 0.91000 | |
| gelatins / puddings: | - | 0.10000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 5.70000 | |
| 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): | |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 18 (FGE.18): Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical group 6 View page or View pdf | |
| Flavouring Group Evaluation 18, Revision 1 (FGE. 18 Rev1)[1] : Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical groups 6 and 8 View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 1118-27-0 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 14234 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 3,7-dimethylocta-1,6-dien-3-yl 3-methylbutanoate | |
| Chemidplus: | 0001118270 |
| RTECS: | RG5927200 for cas# 1118-27-0 |
References:
| 3,7-dimethylocta-1,6-dien-3-yl 3-methylbutanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 1118-27-0 |
| Pubchem (cid): | 14234 |
| Pubchem (sid): | 134979620 |
| Flavornet: | 1118-27-0 |
| Pherobase: | View |
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): | HMDB30428 |
| FooDB: | FDB002292 |
| Export Tariff Code: | 2915.60.0000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| apple | FR | |
| apricot | FR | |
| bergamot | FR | |
| cranberry | FR | |
| exotic | ||
| gardenia | FR | |
| gooseberry | FR | |
| honeysuckle | FR | |
| lavender | FR | |
| magnolia | FR | |
| peach | FR | |
| pineapple | FR | |
| pistachio | FL | |
| plum | FR | |
| sage | FR | |
| sassafras | FR | |
| wisteria | FR |
Occurrence (nature, food, other): note
| sage Search Trop Picture | |
| salvia spinosa Search Trop Picture |
Synonyms:
| 1,5- | dimethyl-1-vinyl hex-4-enyl 3-methyl butanoate |
| 1,5- | dimethyl-1-vinyl hex-4-enyl isovalerate |
| 3,7- | dimethyl-1,6-octadien-3-yl 3-methyl butanoate |
| 3,7- | dimethyl-1,6-octadien-3-yl isovalerate |
| 3,7- | dimethylocta-1,6-dien-3-yl 3-methylbutanoate |
| linalyl 3-methyl butanoate | |
| linalyl isopentanoate | |
| linalyl isovalerianate | |
| linalyle isovalerate | |
| 3- | methyl butanoic acid 1-ethenyl-1,5-dimethyl-4-hexenyl ester |
| 1,6- | octadien-3-ol, 4,7-dimethyl-, isovalerate |
| iso | valeric acid (4,7-dimethyl-1,6-octadien-3-yl) ester |
| iso | valeric acid 1,5-dimethyl-1-vinyl-4-hexenyl ester |
| iso | valeric acid linalyl ester |
| iso | valeric acid, (4,7-dimethyl-1,6-octadien-3-yl) ester |