Articles:
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prenyl caproate
Notes:
Used as a food additive [EAFUS]
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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): 76649-22-4 Prenyl caproate
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SRS Aromatics Ltd For over 25 years Bringing flavour and fragrance into your world. As suppliers / distributors of ingredients to the fragrance and flavour industries, our goal is to provide high quality materials at competitive prices with an exceptional level of service. Established in 1984, SRS Aromatics Ltd is an independent family owned business which has become very well-respected within the fragrance and flavour industry as a reliable and trustworthy partner. Over the years this has allowed the company to develop strong relationships with many global manufacturers; several of whom we represent in the UK. A core aim of our business is to work extremely closely with both our suppliers and customers to maximise service levels with minimum disruption to supply. Email: Info Email: Sales Voice: +44 (0) 1284 704076 Fax: +44 (0) 1284 760819 Twitter Linkedin News Product(s): VERTENOL CAPROATE
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| CAS Number: | 76649-22-4 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 278-515-7 | |
| FDA UNII: | 44Y3T9J41Z | |
| Nikkaji Web: | J319.349G | |
| XlogP3-AA: | 3.50 (est) | |
| Molecular Weight: | 184.27880000 | |
| Formula: | C11 H20 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: | 1829 prenyl caproate |
| FEMA Number: | 4204 prenyl caproate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 76649-22-4 ; PRENYL CAPROATE |
Physical Properties:
Organoleptic Properties:
| Odor Type: fruity | |
| Odor Strength: | medium |
| fruity green cheesy | |
| Odor Description: at 100.00 %. | fruity green cheesy |
| Odor and/or flavor descriptions from others (if found). | |
| Bedoukian Research | |
| PRENYL HEXANOATE | |
| Odor Description: | A mild green fruity odor Used in fruit compositions |
Cosmetic Information:
| None found |
Suppliers:
| Axsyn |
| For experimental / research use only. |
| Hexanoic acid,3-methyl-2-buten-1-yl ester |
| BOC Sciences |
| For experimental / research use only. |
| Prenyl caproate |
| Grau Aromatics |
| VERTENOL-CAPROATE (PRENYL-CAPROATE)
Kosher |
| SRS Aromatics |
| VERTENOL CAPROATE |
Safety Information:
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 10 - Flammable. R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. 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 37/39 - Wear suitable gloves and eye/face protection. | |
| 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: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| 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 prenyl hexanoate usage levels up to: | |||
| 8.0000 % in the fragrance concentrate. | |||
| 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: 22 | |||
| Click here to view publication 22 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | 10.00000 | 100.00000 | |
| beverages(nonalcoholic): | 0.30000 | 3.00000 | |
| beverages(alcoholic): | 1.50000 | 15.00000 | |
| breakfast cereal: | 0.30000 | 1.50000 | |
| cheese: | - | - | |
| chewing gum: | 15.00000 | 100.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 1.50000 | 10.00000 | |
| egg products: | 1.50000 | 10.00000 | |
| fats / oils: | 1.50000 | 10.00000 | |
| fish products: | - | - | |
| frozen dairy: | 6.00000 | 60.00000 | |
| fruit ices: | 3.00000 | 30.00000 | |
| gelatins / puddings: | 3.00000 | 30.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 5.00000 | 50.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | 0.60000 | 6.00000 | |
| jams / jellies: | 3.00000 | 30.00000 | |
| meat products: | - | - | |
| milk products: | 0.60000 | 60.00000 | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | 1.50000 | 15.00000 | |
| snack foods: | - | - | |
| soft candy: | 3.00000 | 30.00000 | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 76649-22-4 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 173534 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| 3-methylbut-2-enyl hexanoate | |
| Chemidplus: | 0076649224 |
References:
| 3-methylbut-2-enyl hexanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 173534 |
| Pubchem (sid): | 135192669 |
| 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 |
| KEGG (GenomeNet): | C13422 |
| HMDB (The Human Metabolome Database): | HMDB32489 |
| FooDB: | FDB010135 |
| Export Tariff Code: | 2915.90.8000 |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| cheese | FL | |
| fruit | FR | |
| green | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| hexanoic acid 3-methyl-2-butenyl ester | |
| hexanoic acid, 3-methyl-2-butenyl ester | |
| 3- | methyl but-2-enyl hexanoate |
| 3- | methyl-2-butenyl hexanoate |
| 3- | methylbut-2-enyl hexanoate |
| prenyl caproate | |
| vertenol caproate (Grau) | |
| vertenol-caproate (Grau) |