Basic information
- CAS
53905-37-6- Standard SMILES
Oc1cc(-c2ccc(Cl)c(O)c2)ccc1Cl- InChIKey
HCMZQOFFKKISQI-UHFFFAOYSA-N- Molecular formula
- C12H8Cl2O2
- Average molar mass
- 255.09 g/mol
- Monoisotopic mass
- 253.9901349
Names & identifiers
- Preferred name
- (1,1'-Biphenyl)-3,3'-diol, 4,4'-dichloro-
- IUPAC
- 2-chloro-5-(4-chloro-3-hydroxyphenyl)phenol
- English name
- 4,4'-Dichloro-(1,1'-biphenyl)-3,3'-diol
- Molecular formula
- C12H8Cl2O2
- Molecular weight
- 255.1
Names & synonyms
53905-37-6(1,1'-Biphenyl)-3,3'-diol, 4,4'-dichloro-DTXSID80202181[1,1'-Biphenyl]-3,3'-diol, 4,4'-dichloro-RefChem:203941DTXCID801246724,4'-Dichloro[1,1'-biphenyl]-3,3'-diolSCHEMBL2476458HCMZQOFFKKISQI-UHFFFAOYSA-N4,4'-dichloro-3,3'-biphenyldiolDB-3051864,4'-Dichloro-(1,1'-biphenyl)-3,3'-diol
Show more names
4,4'-Dichloro[1,1'-biphenyl]-3,3'-diol #
Database identifiers
- CAS
53905-37-6- PubChem CID
- 620336
- DTXSID
DTXSID80202181- Nikkaji
- J542.728B
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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