1-phenethyl isovalerate
butanoic acid, 3-methyl-, 1-phenylethyl ester
Identification
| Name | 1-phenethyl isovalerate |
| IUPAC | 1-phenylethyl 3-methylbutanoate |
| CAS Number | 56961-73-0 |
| EINECS | 260-474-1 |
| FDA UNII | Search |
| Molecular Formula | C13 H18 O2 |
| Molecular Weight | 206.28486000 |
| Nikkaji Number | J260.932K |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 261.00 to 263.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.011000 mmHg @ 25.00 °C. (est) |
| Flash Point | 202.00 °F. TCC ( 94.50 °C. ) (est) |
| logP (o/w) | 3.724 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
No sensory data available
Safety Information
| 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 | fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for 1-phenethyl isovalerate flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
butanoic acid, 3-methyl-, 1-phenylethyl ester
butanoic acid, 3-methyl-, phenylethyl ester
1-
phenyl ethyl isovalerate
1-
phenylethyl 3-methylbutanoate
styrallyl isovalerate
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