5,5-Dimethyl-3-(3-nitroanilino)-2-cyclohexen-1-one
5,5-dimethyl-3-(3-nitroanilino)cyclohex-2-en-1-one
Also Known As: 5,5-dimethyl-3-[(3-nitrophenyl)amino]cyclohex-2-en-1-one|5,5-dimethyl-3-(3-nitroanilino)cyclohex-2-en-1-one|KS-00003P4T|MS-6306|5,5-DIMETHYL-3-((3-NITROPHENYL)AMINO)CYCLOHEX-2-EN-1-ONE|5,5-Dimethyl-3-((3-nitrophenyl)amino)cyclohex-2-enone|I05-1419|2-Cyclohexen-1-one, 5,5-dimethyl-3-[(3-nitrophenyl)amino]-|5,5-DIMETHYL-3-(3-NITROANILINO)-2-CYCLOHEXEN-1-ONE|5,5-dimethyl-3-(3-nitrophenylamino)-cyclohex-2-enone|5,5-Dimethyl-3-[(3-nitrophenyl)amino]-cyclohex-2-en-1-one|5,5-Dimethyl-3-(3-nitrophenyl)aminocyclohex-2-en-1-one|659-118-1
| Molecular Formula | C14H16N2O3 |
|---|---|
| Molecular Weight | 260.1161 g/mol |
| LogP | 3.2797 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.1161 |
| Monoisotopic Mass | 260.1161 |
| Heavy Atoms | 19 |
| Complexity | 561.56445 |
Chemical Identifiers
| CAS Number | 61997-86-2 |
|---|---|
| SMILES | CC1(CC(=CC(=O)C1)NC2=CC(=CC=C2)[N+](=O)[O-])C |
Product Overview
5,5-Dimethyl-3-(3-nitroanilino)-2-cyclohexen-1-one (CAS 61997-86-2), with molecular formula C14H16N2O3 and molecular weight 260.1161 g/mol. IUPAC: 5,5-dimethyl-3-(3-nitroanilino)cyclohex-2-en-1-one.