4-(2-(4-Chlorophenyl)diazenyl)phenol
Basic information
- CAS
189265-69-8- Standard SMILES
Oc1ccc(N=Nc2ccc(Cl)cc2)cc1- InChIKey
MNNLUFVMZSSCJT-UHFFFAOYSA-N- Molecular formula
- C12H9ClN2O
- Average molar mass
- 232.66 g/mol
- Monoisotopic mass
- 232.0403406
Names & identifiers
- Preferred name
- 4-(2-(4-Chlorophenyl)diazenyl)phenol
- IUPAC
- 4-[(4-chlorophenyl)diazenyl]phenol
- English name
- Phenacetin Impurity 11
- Molecular formula
- C12H9ClN2O
- Molecular weight
- 232.67
Names & synonyms
2703-27-7DTXSID5012899794-(2-(4-Chlorophenyl)diazenyl)phenol4-[2-(4-Chlorophenyl)diazenyl]phenolRefChem:1069778DTXCID8017205944-(p-Chlorophenylazo)phenolPhenol, p-((p-chlorophenyl)azo)-4-((4-Chlorophenyl)azo)phenolPhenol, 4-((4-chlorophenyl)azo)-NSC-4025924-[(4-Chlorophenyl)azo]phenol
Show more names
PhecetinImpurity11Phenacetin Impurity 11Phenol, 4-[(1E)-2-(4-chlorophenyl)diazenyl]-
Phenol, 4-[(4-chlorophenyl)azo]-NSC 402592BRN 0958204AI3-09037NSC402592YQ9MFJ8FVZ189265-69-84-hydroxy-4'-chloroazobenzene
Database identifiers
- CAS
189265-69-8、2703-27-7- PubChem CID
- 101244
- DTXSID
DTXSID501289979- ChEMBL
CHEMBL1969613- UNII
- YQ9MFJ8FVZ
- Nikkaji
- J2.423.259J
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Melting point
- 153 · 153-155 °C
- Boiling point
- 410.3 · 410.3±30.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- pka
- 9.01 · 9.01±0.26(Predicted)
- FDA UNII
- 9 MFJ8FVZ · YQ9MFJ8FVZ
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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