3-Methyl-4-(2,4,6-Trimethyl-3-Cyclohexen-1-Yl)-3-Buten-2-One
Aroma Chemical CAS 67801-29-0
3-Methyl-4-(2,4,6-Trimethyl-3-Cyclohexen-1-Yl)-3-Buten-2-One is a herbal, fresh and celery material in the Fragrance Material Index. A written odor description for this material is not yet available.
Odor profile
| Descriptor 1 | Herbal |
| Descriptor 2 | Fresh |
| Descriptor 3 | Celery |
Identification
| CAS Number | 67801-29-0 |
| INCI Name | 3-methyl-4-(2,4,6-trimethyl-3-cyclohexenyl)-3-buten-2-one |
| Category | Aroma Chemical |
| Formula | C14H22O |
| Mol. Weight | 206.32 |
| IUPAC Name | (E)-3-methyl-4-(2,4,6-trimethylcyclohex-3-en-1-yl)but-3-en-2-one |
| InChIKey | PBKBMLILZYXPBO-CSKARUKUSA-N |
Synonyms
3-buten-2-one, 3-methyl-4-(2,4,6-trimethyl-3-cyclohexen-1-yl)-, methyl iritone (IFF), 3-methyl-4-(2,4,6-trimethyl-3-cyclohexenyl)-3-buten-2-one, (E)-3-methyl-4-(2,4,6-trimethylcyclohex-3-en-1-yl)but-3-en-2-one
Physical and chemical data
| Boiling Point | 293.00 °C |
| Flash Point | 126.67 °C |
| Vapor Pressure | 0.002000 mmHg @ 25.00 C. (est) |
| LogP | 4.194 |
| Solubility | alcohol; water, 3.198 mg/L @ 25 C (est) |
| Appearance | colorless to pale yellow clear liquid |
All figures on this page are guide values collected from public reference works and supplier declarations. They differ between batches, origins and qualities. The data sheet of your own supplier is always the authoritative document for the material you actually use.