Basic information
- CAS
17596-04-2- Standard SMILES
Clc1cccc(N=NNc2cccc(Cl)c2)c1- InChIKey
LJFGVHJIOVPLEQ-UHFFFAOYSA-N- Molecular formula
- C12H9Cl2N3
- Average molar mass
- 266.12 g/mol
- Monoisotopic mass
- 265.0173527
Names & identifiers
- Preferred name
- 3-chloro-N-[(3-chlorophenyl)diazenyl]aniline
- IUPAC
- 3-chloro-N-[(3-chlorophenyl)diazenyl]aniline
Names & synonyms
17596-04-2NSC85636SCHEMBL22062053DTXSID50938723NSC-856361,3-Bis(3-chlorophenyl)triaz-1-ene1-Triazene, 1,3-bis[3-chlorophenyl]-
Database identifiers
- CAS
17596-04-2- PubChem CID
- 257534
- DTXSID
DTXSID50938723
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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