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2',3,4',6'-Tetrachloro-4-biphenylol

HCID 644178
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
189578-00-5
Standard SMILES
Oc1ccc(-c2c(Cl)cc(Cl)cc2Cl)cc1Cl
InChIKey
WWRVCWDZLRVHCD-UHFFFAOYSA-N
Molecular formula
C12H6Cl4O
Average molar mass
308 g/mol
Monoisotopic mass
305.917276

Names & identifiers

Preferred name
2',3,4',6'-Tetrachloro-4-biphenylol
IUPAC
2-chloro-4-(2,4,6-trichlorophenyl)phenol

Names & synonyms

2',3,4',6'-Tetrachloro-4-biphenylol189578-00-54-Hydroxy-2',3,4',6'-tetrachlorobiphenylC14380AC1LD8PX2-chloro-4-(2,4,6-trichlorophenyl)phenol4-Hydroxy-3,2',4',6'-tetrachlorobiphenylSureCN463716SCHEMBL463716CHEMBL4102269DTXSID80940470NS00126497
Show more names
2',3,4',6'-Tetrachloro[1,1'-biphenyl]-4-ol[1,1'-biphenyl]-4-ol, 2',3,4',6'-tetrachloro-4-Hydroxy-2a(2),3,4a(2),6a(2)-tetrachlorobiphenyl[1,1'-Biphenyl]-4-ol, 2',3,4',6'-tetrachloro- (9CI)

Database identifiers

CAS
189578-00-5
PubChem CID
644178
DTXSID
DTXSID80940470
ChEMBL
CHEMBL4102269
Nikkaji
J2.788.387G

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
251

Related reactions

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Compound notes

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