Basic information
- CAS
63193-53-3- Standard SMILES
Cc1cccc(NN=Nc2ccccc2)c1- InChIKey
QKKMPBFJDGJQOM-UHFFFAOYSA-N- Molecular formula
- C13H13N3
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.11094743
Names & identifiers
- Preferred name
- 1-Triazene, 1-(3-methylphenyl)-3-phenyl-
- IUPAC
- 3-methyl-N-phenyldiazenylaniline
Names & synonyms
1-Triazene, 1-(3-methylphenyl)-3-phenyl-63193-53-31-(3-Methylphenyl)-3-phenyl benzenamineSCHEMBL431706DTXSID80212543(1E)-3-(3-methylphenyl)-1-phenyltriaz-1-ene
Database identifiers
- CAS
63193-53-3- PubChem CID
- 147516
- DTXSID
DTXSID80212543
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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