2-Methyl-4-(2-phenyldiaz-1-enyl)aniline

HCID 255016

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Basic information

CAS: 1142-13-8
Standard SMILES: Cc1cc(N=Nc2ccccc2)ccc1N
InChIKey: ZQNCDLBRYKNRBK-UHFFFAOYSA-N
Molecular formula: C13H13N3
Average molar mass: 211.26 g/mol
Monoisotopic mass: 211.11094743

Names & identifiers

Preferred name: 2-Methyl-4-(2-phenyldiaz-1-enyl)aniline
IUPAC: 2-methyl-4-phenyldiazenylaniline

Names & synonyms

2-methyl-4-(2-phenyldiaz-1-enyl)aniline1142-13-82-methyl-4-phenyldiazenylanilineBenzenamine, 2-methyl-4-(2-phenyldiazenyl)-2-methyl-4-[(e)-phenyldiazenyl]anilineNSC80167Benzenamine,2-methyl-4-(2-phenyldiazenyl)-3-methyl-4-aminoazobenzeneNCIOpen2_004286SCHEMBL9818179SCHEMBL9818181DTXSID10292055

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NSC-80167DS-006589

Database identifiers

CAS: 1142-13-8
PubChem CID: 255016
DTXSID: DTXSID10292055

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 50.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 233

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