2-Oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile
2-oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile
Also Known As: 2-oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile|Cyclohexanecarbonitrile,2-oxo-3-pentyl-3-phenyl|Cyclohexanecarbonitrile, 2-oxo-3-pentyl-3-phenyl-
CAS: 53586-83-7
| Molecular Formula | C18H23NO |
|---|---|
| Molecular Weight | 269.17798 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 40.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 269.17798 |
| Monoisotopic Mass | 269.17798 |
| Heavy Atoms | 20 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 53586-83-7 |
|---|---|
| SMILES | CCCCCC1(CCCC(C1=O)C#N)C2=CC=CC=C2 |
| InChIKey | NDHXBIVWOXREAR-UHFFFAOYSA-N |
Product Overview
2-Oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile (CAS 53586-83-7), with molecular formula C18H23NO and molecular weight 269.17798 g/mol. IUPAC: 2-oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile.
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.
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2-Oxo-3-pentyl-3-phenylcyclohexane-1-carbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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