1-(4-Chlorophenyl)-2-phenyldiazene
Basic information
- CAS
4340-77-6- Standard SMILES
Clc1ccc(N=Nc2ccccc2)cc1- InChIKey
NJFDMENHTAYHMA-UHFFFAOYSA-N- Molecular formula
- C12H9ClN2
- Average molar mass
- 216.66 g/mol
- Monoisotopic mass
- 216.045426
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-2-phenyldiazene
- IUPAC
- (4-chlorophenyl)-phenyldiazene
- English name
- 1-(4-Chlorophenyl)-2-phenyldiazene
- Molecular formula
- C12H9ClN2
- Molecular weight
- 216.67
Names & synonyms
1-(4-chlorophenyl)-2-phenyldiazeneDTXSID90871069RefChem:1054329DTXCID40818742p-Chloroazobenzene4340-77-64-CHLOROAZOBENZENEAzobenzene, 4-chloro-(Z)-4-ChloroazobenzeneDiazene, (4-chlorophenyl)phenyl-Azobenzene, 4-chloro-, (E)-Diazene, (4-chlorophenyl)phenyl-, (E)-
Show more names
Diazene, 1-(4-chlorophenyl)-2-phenyl-
C12H9ClN26141-95-36530-97-8Diazene, (4-chlorophenyl)phenyl-, (Z)-Azobenzene, 4-chloro-, (Z)-NSC16040NSC 16040p-Chloro-cis-azobenzene
Database identifiers
- CAS
4340-77-6、6141-95-3- PubChem CID
- 20349
- DTXSID
DTXSID90871069- Nikkaji
- J105.346I、J142.086K、J142.087I
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 204
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
LogP4.56
Physicochemical properties
- Melting point
- 88 °C · 88°C
- Boiling point
- 350.93 °C · 350.93°C (rough estimate)
- Density
- 1.2154 · 1.2154 (rough estimate)
- refractive index
- 1.5749 · 1.5749 (estimate)
- Water Solubility
- 433.3 ug/L · 433.3ug/L(25 ºC)
- Henry's Law Constant
- 7.4 · 7.4×100 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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