3-Methyl-2-cyclohexenone
ALDRICH/M39105 - 98%, Stabilized
CAS Number: 1193-18-6
Empirical Formula (Hill Notation): C7H10O
Molecular Weight: 110.15
EC Number: 214-769-7
MDL Number: MFCD00001581
Linear Formula: CH3C6H7(=O)
Product Type: Chemical
| assay | 98% |
| bp | 199-200 °C (lit.) |
| density | 0.971 g/mL at 25 °C (lit.) |
| InChI | 1S/C7H10O/c1-6-3-2-4-7(8) |
| InChI key | IITQJMYAYSNIMI-UHFFFAOYSA |
| refractive index | n |
| SMILES string | CC1=CC(=O)CCC1 |
| Application: | 3-Methyl-2-cyclohexenone is an insect sex pheromone of the Douglas-fir beetle. It can be used as a starting material: • In the total synthesis of (−)-ar-tenuifolene, a naturally occurring aromatic sesquiterpene. • To synthesize an organic building block 2-trimethylsilyl-3-methyl • In the total synthesis of natural diterpenoids (+)-taiwaniaquinone H and (+)-dichroanone. |
| Packaging: | 10, 50 g in glass bottle |
| Symbol |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302 |
| Hazard Codes | Xn |
| Risk Statements | 22 |
| WGK Germany | WGK 3 |
| Flash Point(F) | 154.4 °F - closed cup |
| Flash Point(C) | 68 °C - closed cup |
| Purity | 98% |
| bp | 199-200 °C (lit.) |
| Density | 0.971 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |