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4-Chloro-2-(4-chlorophenylazo)phenol

HCID 574111
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Basic information

CAS
2491-55-6
Standard SMILES
Oc1ccc(Cl)cc1N=Nc1ccc(Cl)cc1
InChIKey
KVTZMQCZCURMPK-UHFFFAOYSA-N
Molecular formula
C12H8Cl2N2O
Average molar mass
267.11 g/mol
Monoisotopic mass
266.0013683

Names & identifiers

Preferred name
4-Chloro-2-(4-chlorophenylazo)phenol
IUPAC
4-chloro-2-[(4-chlorophenyl)diazenyl]phenol
English name
4-Chloro-2-[(E)-(4-chlorophenyl)diazenyl]phenol
Molecular formula
C12H8Cl2N2O
Molecular weight
267.11

Names & synonyms

2491-55-64-Chloro-2-(4-chlorophenylazo)phenolDTXSID80425631KVTZMQCZCURMPK-FOCLMDBBSA-NAKOS0034368374-Chloro-2-[(E)-(4-chlorophenyl)diazenyl]phenol #4-Chloro-6-[2-(4-chlorophenyl)hydrazinylidene]cyclohexa-2,4-dien-1-one4-Chloro-2-[(E)-(4-chlorophenyl)diazenyl]phenolPhenol, 4-chloro-2-[2-(4-chlorophenyl)diazenyl]-

Database identifiers

CAS
2491-55-6
PubChem CID
574111
DTXSID
DTXSID80425631

Properties

Computed structural propertiesFilling in

XLogP
4.6
Topological polar surface area
45 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
267

Physicochemical properties

Melting point
157.5 °C · 157.5 °C
Boiling point
428.966 · 428.966±45.00 °C(Press: 760.00 Torr)(predicted)
Density
1.376 · 1.376±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
7.91 · 7.910±0.43(predicted)

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