3,3-Dimethyl-5-oxo-2-phenylhexanenitrile
3,3-dimethyl-5-oxo-2-phenylhexanenitrile
Also Known As: 3,3-dimethyl-5-oxo-2-phenylhexanenitrile|5-Oxo-3,3-dimethyl-2-phenylhexanenitrile|3,3-Dimethyl-5-oxo-2-phenyl-hexanenitrile
CAS: 62071-29-8
| Molecular Formula | C14H17NO |
|---|---|
| Molecular Weight | 215.13101 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 40.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 215.13101 |
| Monoisotopic Mass | 215.13101 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 62071-29-8 |
|---|---|
| SMILES | CC(=O)CC(C)(C)C(C#N)C1=CC=CC=C1 |
| InChIKey | IOMBQFNGNQILIJ-UHFFFAOYSA-N |
Product Overview
3,3-Dimethyl-5-oxo-2-phenylhexanenitrile (CAS 62071-29-8), with molecular formula C14H17NO and molecular weight 215.13101 g/mol. IUPAC: 3,3-dimethyl-5-oxo-2-phenylhexanenitrile.
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 →
3,3-Dimethyl-5-oxo-2-phenylhexanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »