4-((4-Aminophenyl)azo)1,3-benzenediamine
Basic information
- CAS
6364-34-7- Standard SMILES
Nc1ccc(N=Nc2ccc(N)cc2N)cc1- InChIKey
CLJINDGUQZQLEL-UHFFFAOYSA-N- Molecular formula
- C12H13N5
- Average molar mass
- 227.27 g/mol
- Monoisotopic mass
- 227.11709544
Names & identifiers
- Preferred name
- 4-((4-Aminophenyl)azo)1,3-benzenediamine
- IUPAC
- 4-[(4-aminophenyl)diazenyl]benzene-1,3-diamine
- English name
- 4-[(4-Aminophenyl)azo]-1,3-benzenediamine
- Molecular formula
- C12H13N5
- Molecular weight
- 227.27
Names & synonyms
6364-34-74-((4-AMINOPHENYL)AZO)1,3-BENZENEDIAMINEDTXSID6010379091,3-Benzenediamine, 4-[2-(4-aminophenyl)diazenyl]-C.I.11275Bistramine Brown G2,4,4'-Triaminoazobenzenep-(2,4-Diaminophenylazo)aniline4-[(4-Aminophenyl)azo]-1,3-benzenediamine
Database identifiers
- CAS
6364-34-7- PubChem CID
- 22850
- DTXSID
DTXSID601037909- Nikkaji
- J30.276G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
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Compound notes
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