Basic information
- CAS
123535-85-3- Standard SMILES
O[C@H](c1ccccc1)c1ccc(Cl)cc1- InChIKey
AJYOOHCNOXWTKJ-CYBMUJFWSA-N- Molecular formula
- C13H11ClO
- Average molar mass
- 218.68 g/mol
Names & identifiers
- Preferred name
- 4-Chlorobenzhydrol, (R)-
- IUPAC
- (R)-(4-chlorophenyl)-phenylmethanol
- English name
- (R)-4-Chlorophenyl benzenemethanol
- Molecular formula
- C13H11ClO
- Molecular weight
- 218.68
Names & synonyms
(R)-4-Chlorobenzhydrol123535-85-34-Chlorobenzhydrol, (R)-(-)-4-Chlorobenzhydrol4-Chlorobenzhydrol, (-)-PA8COP3FYCUNII-PA8COP3FYC(alphaR)-4-Chloro-alpha-phenylbenzenemethanolBenzenemethanol, 4-chloro-alpha-phenyl-, (alphaR)-(.ALPHA.R)-4-CHLORO-.ALPHA.-PHENYLBENZENEMETHANOLBENZENEMETHANOL, 4-CHLORO-.ALPHA.-PHENYL-, (.ALPHA.R)-RefChem:198644
Show more names
(R)-4-chloro-diphenylmethanolLevocloperastine CBZ (R)-IsomerBenzenemethanol, 4-chloro-α-phenyl-, (αR)-
(R)-(4-chlorophenyl)-phenylmethanol(R)-(4-Chlorophenyl)(phenyl)methanol(R)-4-Chlorophenyl benzenemethanolSCHEMBL477349CHEMBL2251570Q27286438
Database identifiers
- CAS
123535-85-3- PubChem CID
- 852996
- ChEMBL
CHEMBL2251570- UNII
- PA8COP3FYC
- Nikkaji
- J595.877F
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Melting point
- 54 · 54-55 °C
- Boiling point
- 352.164 · 352.164±27.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.221 · 1.221±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.344 · 13.344±0.20(predicted)
- FDA UNII
- 8 COP3FYC · PA8COP3FYC
Chemistry & industry
Suppliers6 total
石家庄州昆医药科技有限公司0311-83784138 18633934202 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海砾久生物科技有限公司17821611619 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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