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Basic information
- CAS
23719-22-4- Standard SMILES
Oc1ccc(-c2ccccc2)c(Cl)c1- InChIKey
MXORDJXBRHNWBE-UHFFFAOYSA-N- Molecular formula
- C12H9ClO
- Average molar mass
- 204.65 g/mol
- Monoisotopic mass
- 204.0341926
Names & identifiers
- Preferred name
- 2-Chloro-4-biphenylol
- IUPAC
- 3-chloro-4-phenylphenol
- English name
- 4-Hydroxy-2-chlorobiphenyl
- Molecular formula
- C12H9ClO
- Molecular weight
- 204.65
Names & synonyms
2-chloro-4-biphenylol23719-22-44-HYDROXY-2-CHLOROBIPHENYLDL6RKR6ERHUNII-DL6RKR6ERH(1,1'-Biphenyl)-4-ol, 2-chloro-2-chloro-[1,1'-biphenyl]-4-ol2-Chloro-(1,1'-biphenyl)-4-ol4-BIPHENYLOL, 2-CHLORO-PHENOL, O-(P-CHLOROPHENYL)-RefChem:1977223-chloro-4-phenylphenol
Show more names
4-Hydroxy-2-chlorobiphenyl @100 μg/mL in Isooctane
2-Chloro-4-hydroxybiphenyl2-chlorobiphenyl-4-olDTXSID0022353DTXCID502353SCHEMBL2288038CHEMBL3187101SCHEMBL16719843CHEBI:34268
Database identifiers
- CAS
23719-22-4- PubChem CID
- 79688
- DTXSID
DTXSID80870425- ChEMBL
CHEMBL3187101- ChEBI
CHEBI:34268- UNII
- DL6RKR6ERH
- Nikkaji
- J542.165I
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Experimental & physicochemical properties
Kovats Retention Index1748
Collision Cross Section147 Ų [M-H]-
Physicochemical properties
- Boiling point
- 315.4 · 315.4±22.0 °C(Predicted)
- Density
- 1.239 · 1.239±0.06 g/cm3(Predicted)
- pka
- 8.91 · 8.91±0.18(Predicted)
- FDA UNII
- 6 RKR6ERH · DL6RKR6ERH
Chemistry & industry
Suppliers5 total
上海鑫凯化学科技有限公司021-58930698 15921516558 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Additional notes
DefinitionChEBI: 2-Chloro-4-biphenylol is a member of biphenyls and an organochlorine compound.
Related reactions
1 records
Compound notes
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