2-(1-Methylheptyl)cyclohexanone
2-octan-2-ylcyclohexan-1-one
Also Known As: 2- cyclohexanone|2-(1-Methylheptyl)cyclohexanone|2-octan-2-ylcyclohexan-1-one|Cyclohexanone, 2-(1-methylheptyl)-|2-(octan-2-yl)cyclohexan-1-one|2-(1-Methylheptyl)cyclohexanone #
CAS: 54549-90-5
| Molecular Formula | C14H26O |
|---|---|
| Molecular Weight | 210.19836 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.19836 |
| Monoisotopic Mass | 210.19836 |
| Heavy Atoms | 15 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 54549-90-5 |
|---|---|
| SMILES | CCCCCCC(C)C1CCCCC1=O |
| InChIKey | BQMQNEXTTHKHPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (5 patents)
Product Overview
2-(1-Methylheptyl)cyclohexanone (CAS 54549-90-5), with molecular formula C14H26O and molecular weight 210.19836 g/mol. IUPAC: 2-octan-2-ylcyclohexan-1-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 →
2-(1-Methylheptyl)cyclohexanone is a custom synthesis product. We offer services from milligram to kilogram scale.
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