[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol

C14H12ClFO2 — CID 141261609

IUPAC[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol
SMILESOCc1cc(Cl)ccc1C(O)c1ccc(F)cc1
InChIInChI=1S/C14H12ClFO2/c15-11-3-6-13(10(7-11)8-17)14(18)9-1-4-12(16)5-2-9/h1-7,14,17-18H,8H2
InChIKeyQRFAYELQIBGYSH-UHFFFAOYSA-N
MW266.70 g/mol
LogP3.05
Rot. Bonds3

About [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol

[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol (PubChem CID 141261609) has the molecular formula C14H12ClFO2 and a molecular weight of 266.70 g/mol. Its IUPAC name is [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol
PubChem CID141261609
Molecular FormulaC14H12ClFO2
Molecular Weight266.70 g/mol
Exact Mass266.05
IUPAC Name[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol
SMILESOCc1cc(Cl)ccc1C(O)c1ccc(F)cc1
InChIInChI=1S/C14H12ClFO2/c15-11-3-6-13(10(7-11)8-17)14(18)9-1-4-12(16)5-2-9/h1-7,14,17-18H,8H2
InChIKeyQRFAYELQIBGYSH-UHFFFAOYSA-N
XLogP3.05
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.70
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,4-dichlorophenyl)-(4-fluorophenyl)methanol
CID 20506318
(4-chloro-2-fluorophenyl)-(4-iodophenyl)methanol
CID 115827844
(2-ethyl-4-fluorophenyl)-(4-fluorophenyl)methanol
CID 146466403
(4-bromophenyl)-(4-chloro-2-fluorophenyl)methanol
CID 61101398
(5-chloro-2-fluorophenyl)-(4-chlorophenyl)methanol
CID 61100029
[2-(1-amino-2,2-difluoroethyl)-5-chlorophenyl]methanol
CID 142148919
4-chloro-1-[chloro-(4-fluorophenyl)methyl]-2-fluorobenzene
CID 55198108
(4-chloro-2-fluorophenyl)-naphthalen-2-ylmethanol
CID 63081233
(4-chlorophenyl)-(5-fluoro-2-methylphenyl)methanol
CID 55133948
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989
(4-chloro-2-fluorophenyl)-(4-propoxyphenyl)methanol
CID 63082099
(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol
CID 105394068

Frequently Asked Questions

What is the IUPAC name of [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol?
The IUPAC name of [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol (CID 141261609) is [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol.
What is the SMILES notation for [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol?
The canonical SMILES for [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol is OCc1cc(Cl)ccc1C(O)c1ccc(F)cc1.
What is the InChIKey of [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol?
The InChIKey is QRFAYELQIBGYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFO2/c15-11-3-6-13(10(7-11)8-17)14(18)9-1-4-12(16)5-2-9/h1-7,14,17-18H,8H2.
What are the key properties of [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol?
[4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol has a molecular weight of 266.70 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-2-(hydroxymethyl)phenyl]-(4-fluorophenyl)methanol is sourced from PubChem (CID 141261609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).