1,1-Dimethyl-4-phenyl-1lambda(5)-azepane-4-carbonitrile
1,1-dimethyl-4-phenylazepan-1-ium-4-carbonitrile
Also Known As: NCI60_003742|1,1-Dimethyl-4-phenyl-1lambda(5)-azepane-4-carbonitrile|1,1-dimethyl-4-phenylazepan-1-ium-4-carbonitrile|1,1-dimethyl-4-phenyl-azepan-1-ium-4-carbonitrile|1,1-Dimethyl-4-phenyl-1.lambda.~5~-azepane-4-carbonitrile
CAS: 7512-10-9
| Molecular Formula | C15H21N2+ |
|---|---|
| Molecular Weight | 229.17047 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.17047 |
| Monoisotopic Mass | 229.17047 |
| Heavy Atoms | 17 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 7512-10-9 |
|---|---|
| SMILES | C[N+]1(CCCC(CC1)(C#N)C2=CC=CC=C2)C |
| InChIKey | YWGSRELTNDVXPS-UHFFFAOYSA-N |
Product Overview
1,1-Dimethyl-4-phenyl-1lambda(5)-azepane-4-carbonitrile (CAS 7512-10-9), with molecular formula C15H21N2+ and molecular weight 229.17047 g/mol. IUPAC: 1,1-dimethyl-4-phenylazepan-1-ium-4-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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1,1-Dimethyl-4-phenyl-1lambda(5)-azepane-4-carbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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