valerenolic acid
2-propenoic acid, 3-(2,4,5,6,7,7a-hexahydro-1-hydroxy-3,7-dimethyl-1H-inden-4-yl)-2-methyl-
Identification
| Name | valerenolic acid |
| IUPAC | (E)-3-(1-hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid |
| CAS Number | 81397-68-4 |
| FDA UNII | Search |
| Molecular Formula | C15 H22 O3 |
| Molecular Weight | 250.33794000 |
| Nikkaji Number | J3.045.285B |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 426.02 °C. @ 760.00 mm Hg (est) |
| Flash Point | 438.00 °F. TCC ( 225.60 °C. ) (est) |
| logP (o/w) | 3.116 (est) |
| Soluble in | water, 178.8 mg/L @ 25 °C (est) |
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 | natural substances and extractives |
| Recommendation for valerenolic acid usage levels up to | not for fragrance use. |
| Recommendation for valerenolic acid flavor usage levels up to | not for flavor use. |
No supplier data available
Potential Uses
Natural Occurrence
Synonyms
3-(2,4,5,6,7,7a-
hexahydro-1-hydroxy-3,7-dimethyl-1H-inden-4-yl)-2-methyl-2-propenoic acid
(E)-3-(1-
hydroxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl)-2-methylprop-2-enoic acid
2-
propenoic acid, 3-(2,4,5,6,7,7a-hexahydro-1-hydroxy-3,7-dimethyl-1H-inden-4-yl)-2-methyl-
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