N-[(E)-1-cyclohexylethylideneamino]-2,4-dinitroaniline
Basic information
- CAS
1160-74-3- Standard SMILES
C/C(=N\Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCCC1- InChIKey
XCZTYQZOZZNVIK-XNTDXEJSSA-N- Molecular formula
- C14H18N4O4
- Average molar mass
- 306.32 g/mol
- Monoisotopic mass
- 306.13280507
Names & identifiers
- Preferred name
- N-[(E)-1-cyclohexylethylideneamino]-2,4-dinitroaniline
- IUPAC
- N-[(E)-1-cyclohexylethylideneamino]-2,4-dinitroaniline
Names & synonyms
NSC171208NSC-171208AB00713052-01SR-01000033337SR-01000033337-1Z49555126
Database identifiers
- CAS
1160-74-3- PubChem CID
- 9554649
- Nikkaji
- J80.208E
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 437
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Compound notes
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