4-Methylcyclohexanone
ALDRICH/173614 - 99%
Synonym: Tetrahydro-p-cresol
CAS Number: 589-92-4
Empirical Formula (Hill Notation): C7H12O
Molecular Weight: 112.17
EC Number: 209-665-3
MDL Number: MFCD00001643
Linear Formula: CH3C6H9(=O)
Product Type: Chemical
| assay | 99% |
| bp | 169-171 °C (lit.) |
| density | 0.914 g/mL at 25 °C (lit.) |
| form | liquid |
| functional group | ketone |
| InChI | 1S/C7H12O/c1-6-2-4-7(8)5- |
| InChI key | VGVHNLRUAMRIEW-UHFFFAOYSA |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | CC1CCC(=O)CC1 |
| Application: | 4-Methylcyclohexanone was used in the synthesis of the pinguisane-type sesquiterpenoid acutifolone A, in racemic form. |
| Packaging: | 25, 100, 500 mL in glass bottle |
| Symbol |   GHS02,GHS07 |
| Signal word | Warning |
| Hazard statements | H226 - H302 |
| Precautionary statements | P210 - P301 + P312 + P330 |
| Hazard Codes | Xn |
| Risk Statements | 10-22 |
| Safety Statements | 16-36 |
| RIDADR | UN 2297 3 / PGIII |
| WGK Germany | WGK 1 |
| Flash Point(F) | 118.4 °F - closed cup |
| Flash Point(C) | 48 °C - closed cup |
| Purity | 99% |
| bp | 169-171 °C (lit.) |
| Density | 0.914 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 3948 |
| UNSPSC | 12352100 |