Azepan-1-yl-(4-nitrophenyl)methanone
azepan-1-yl-(4-nitrophenyl)methanone
Also Known As: 1-(4-nitrobenzoyl)azepane|Oprea1_407215|CBDivE_013061|azepan-1-yl-(4-nitrophenyl)methanone|azepan-1-yl(4-nitrophenyl)methanone|azaperhydroepinyl 4-nitrophenyl ketone|KS-000044I9|SR-01000203385-1
CAS: 5157-64-2
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.11609 g/mol |
| LogP | 2.611 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.11609 |
| Monoisotopic Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 434.0545 |
Chemical Identifiers
| CAS Number | 5157-64-2 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
Azepan-1-yl-(4-nitrophenyl)methanone (CAS 5157-64-2), with molecular formula C13H16N2O3 and molecular weight 248.11609 g/mol. IUPAC: azepan-1-yl-(4-nitrophenyl)methanone.
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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