calacone
3-isopropyl-6-methyl-2-(3-methyl-3-buten-1-yl)-2-cyclohexen-1-one
Identification
| Name | calacone |
| IUPAC | 6-methyl-2-(3-methylbut-3-enyl)-3-propan-2-ylcyclohex-2-en-1-one |
| CAS Number | 5957-62-0 |
| FDA UNII | Search |
| Molecular Formula | C15 H24 O |
| Molecular Weight | 220.35548000 |
| Nikkaji Number | J83.330D |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 308.19 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.001000 mmHg @ 25.00 °C. (est) |
| Flash Point | 286.00 °F. TCC ( 141.20 °C. ) (est) |
| logP (o/w) | 3.772 (est) |
| Soluble in | water, 0.6823 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 calacone usage levels up to | not for fragrance use. |
| Recommendation for calacone flavor usage levels up to | not for flavor use. |
No supplier data available
Potential Uses
Natural Occurrence
Synonyms
6-
methyl-2-(3-methylbut-3-enyl)-3-propan-2-ylcyclohex-2-en-1-one
3-iso
propyl-6-methyl-2-(3-methyl-3-buten-1-yl)-2-cyclohexen-1-one
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