Basic information
- CAS
17596-05-3- Standard SMILES
Clc1ccccc1N=NNc1ccccc1Cl- InChIKey
YWFBICWAYSUKBW-UHFFFAOYSA-N- Molecular formula
- C12H9Cl2N3
- Average molar mass
- 266.12 g/mol
- Monoisotopic mass
- 265.0173527
Names & identifiers
- Preferred name
- 1-Triazene, 1,3-bis(2-chlorophenyl)-
- IUPAC
- 2-chloro-N-[(2-chlorophenyl)diazenyl]aniline
Names & synonyms
1-triazene, 1,3-bis(2-chlorophenyl)-17596-05-3DTXSID002928021-Triazene, 1,3-bis[2-chlorophenyl]-RefChem:235511DTXCID30243943NSC85635CHEMBL352795NSC-85635(1E)-1,3-bis(2-chlorophenyl)triaz-1-ene
Database identifiers
- CAS
17596-05-3- PubChem CID
- 257533
- DTXSID
DTXSID00292802- ChEMBL
CHEMBL352795- Nikkaji
- J2.888.782E
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 260
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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