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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 Products List: View Product(s): 148 trans-2-HEXENYL VALERATE
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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): 08-36610 trans-2-HEXENYL VALERATE, Kosher
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| [(E)-hex-2-enyl] pentanoate (Click)
IUPAC Name: [(E)-hex-2-enyl] pentanoate
Std.InChI: InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+
InChI: InChI=1/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+
Std.InChIKey: WDXAMNXWZLXISB-BQYQJAHWSA-N
InChIKey: WDXAMNXWZLXISB-BQYQJAHWBZ
SMILES: CCCCC(=O)OC/C=C/CCC
| |
| CAS Number: | 56922-74-8 |
| ECHA EC Number: | 260-439-0 |
| FDA UNII: | NQO2JJ740G |
| MDL: | MFCD00036547 |
| FEMA Number: | 3935 |
| XlogP3-AA: | 3.30 (est) |
| Molecular Weight: | 184.27880000 |
| Formula: | C11 H20 O2 |
| NMR Predictor: | Predict |
| 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: | 1379 trans-2-hexenyl pentanoate |
| FEMA Number: | 3935 (E)-2-hexenyl valerate |
| FDA Mainterm: | (E)-2-HEXENYL VALERATE |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 93.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.87300 to 0.87900 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 7.264 to 7.314 |
| Refractive Index: | 1.43100 to 1.43800 @ 20.00 °C. |
| Boiling Point: | 70.00 °C. @ 1.00 mm Hg |
| Acid Value: | 3.00 max. KOH/g |
| Vapor Pressure: | 0.046400 mm/Hg @ 25.00 °C. |
| Flash Point: | 170.00 °F. TCC ( 76.67 °C. ) |
| logP (o/w): | 4.170 |
Organoleptic Properties:
| Odor Type: | green |
| Odor Strength: | medium , recommend smelling in a 10.00 % solution or less |
| Odor Description: at 10.00 % in dipropylene glycol. | green fruity apple banana pineapple cognac |
| Odor Description: at 1.00 %. | Green, estry, fruity, apple, green banana and pineapple with slight cognac and winey nuances Mosciano, Gerard P&F 25, No. 5, 72, (2000) |
| Taste Description: at 1.00 - 10.00 ppm. | Waxy green fruity apple, pear and pineapple with a slight waxy floral aftertaste Mosciano, Gerard P&F 25, No. 5, 72, (2000) |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| Bedoukian Research |
| trans-2-HEXENYL VALERATE |
| Parchem |
| (E)-2-hexen-1-yl valerate |
| Penta International |
| trans-2-HEXENYL VALERATE, Kosher |
| TCI AMERICA |
| trans-2-Hexenyl Valerate >94.0%(GC) |
| For experimental / research use only. |
Safety Information:
| 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 | ||
| Recommendation for (E)-2-hexen-1-yl valerate usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
| Recommendation for (E)-2-hexen-1-yl valerate flavor usage levels up to: | |||
| 10.0000 ppm in the finished product. | |||
Safety References:
| EPI System: | View |
| Chemicalize.org: | Calculate predicted properties |
| EPA Substance Registry Services (TSCA): | 56922-74-8 |
| EPA ACToR: | Toxicology Data |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 2 |
| [(E)-hex-2-enyl] pentanoate | |
| Chemidplus: | 0056922748 |
| RTECS: | SA3697500 for cas# 56922-74-8 |
References:
| [(E)-hex-2-enyl] pentanoate | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 56922-74-8 |
| Pubchem (cid): | 5352974 |
| Pubchem (sid): | 135048708 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2009 |
| (IUPAC): | Atomic Weights of the Elements 2009 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Everything Added to Food in the United States (EAFUS): | View |
| Export Tariff Code: | 2915.60.0000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| apple | FL | |
| apricot | FL | |
| banana | FL | |
| brandy | FL | |
| butter | FL | |
| cognac | FL | |
| fruit | ||
| peach | FL | |
| pear | FL | |
| pineapple | FL | |
| rum | FL | |
| wine | FL |
Natural Occurrence in: note
| starfruit GRIN Trop Picture | |
| tea leaf |
Synonyms:
| (2E)- | hex-2-en-1-yl valerate | ||
| (E)- | hex-2-enyl valerate | ||
| [(E)- | hex-2-enyl] pentanoate | ||
| (E)-2- | hexen-1-yl pentanoate | ||
| trans-2- | hexen-1-yl pentanoate | ||
| (E)-2- | hexen-1-yl valerate | ||
| trans-2- | hexen-1-yl valerate | ||
| (E)-2- | hexenyl pentanoate | ||
| trans-2- | hexenyl pentanoate | ||
| (E)-2- | hexenyl valerate | ||
| trans-2- | hexenyl valerate | ||
| pentanoic acid (2E)-2-hexen-1-yl ester | |||
| (E)- | pentanoic acid 2-hexen-1-yl ester | ||
| pentanoic acid, (2E)-2-hexen-1-yl ester | |||
| pentanoic acid, (2E)-2-hexenyl ester | |||
| pentanoic acid, 2-hexenyl ester, (E)- |
