N-[(4-methylphenyl)methylideneamino]-4-nitroaniline

HCID 252599

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Basic information

CAS: 10477-83-5
Standard SMILES: Cc1ccc(C=NNc2ccc([N+](=O)[O-])cc2)cc1
InChIKey: ZOAAHAWFYOXJHZ-UHFFFAOYSA-N
Molecular formula: C14H13N3O2
Average molar mass: 255.27 g/mol
Monoisotopic mass: 255.10077667

Names & identifiers

Preferred name: N-[(4-methylphenyl)methylideneamino]-4-nitroaniline
IUPAC: N-[(4-methylphenyl)methylideneamino]-4-nitroaniline

Names & synonyms

10477-83-5NSC 746781-[(4-Methylphenyl)methylidene]-2-(4-nitrophenyl)hydrazineN-[(4-methylphenyl)methylideneamino]-4-nitroanilineBenzaldehyde,4-methyl-, 2-(4-nitrophenyl)hydrazoneSCHEMBL28072285DTXSID70291286DS-006485

Database identifiers

CAS: 10477-83-5
PubChem CID: 252599
DTXSID: DTXSID70291286

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 70.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 311

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