(E)-cinnamyl isovalerate
butanoic acid, 3-methyl-, (2E)-3-phenyl-2-propen-1-yl ester
Identification
| Name | (E)-cinnamyl isovalerate |
| IUPAC | [(E)-3-phenylprop-2-enyl] 3-methylbutanoate |
| CAS Number | 69121-78-4 |
| FDA UNII | 5JHK9Y2XRM |
| Molecular Formula | C14 H18 O2 |
| Molecular Weight | 218.29586000 |
| MDL Number | MFCD00048351 |
| Nikkaji Number | J503.383G |
| Beilstein | 3201227 |
| CoE Number | 454 |
| XlogP3 | 3.90 (est) |
Regulatory
Physical Properties
| Appearance | colorless to pale yellow clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | Yes |
| Specific Gravity | 0.99100 to 0.99600 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.246 to 8.288 |
| Refractive Index | 1.51800 to 1.52400 @ 20.00 °C. |
| Boiling Point | 313.00 to 315.00 °C. @ 760.00 mm Hg |
| Acid Value | 3.00 max. KOH/g |
| Vapor Pressure | 0.000260 mmHg @ 25.00 °C. (est) |
| Flash Point | > 230.00 °F. TCC ( > 110.00 °C. ) |
| logP (o/w) | 4.013 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 100 hour(s) at 100.00 % |
| Odor Description | at 100.00 %. |
| Taste Description | fruity cherry melon pineapple green |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for (E)-cinnamyl isovalerate usage levels up to | 8.0000 % in the fragrance concentrate. |
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Potential Uses
Natural Occurrence
Synonyms
butanoic acid, 3-methyl-, (2E)-3-phenyl-2-propen-1-yl ester
trans-
cinnamyl isovalerate
(2E)-3-
phenylprop-2-en-1-yl 3-methylbutanoate
[(E)-3-
phenylprop-2-enyl] 3-methylbutanoate
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