4-Methylhex-4-en-3-one
4-methylhex-4-en-3-one
Also Known As: 4-methylhex-4-en-3-one|4-Hexen-3-one, 4-methyl-, (E)-
CAS: 62332-64-3
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.08881 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.08881 |
| Monoisotopic Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 62332-64-3 |
|---|---|
| SMILES | CCC(=O)C(=CC)C |
| InChIKey | LJQNVNNQRWKTJP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (18 patents)
Organic Building Blocks (22 patents)
Pharmaceutical Intermediates (2 patents)
Surfactants & Detergents (2 patents)
Product Overview
4-Methylhex-4-en-3-one (CAS 62332-64-3), with molecular formula C7H12O and molecular weight 112.08881 g/mol. IUPAC: 4-methylhex-4-en-3-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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