(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol

C13H8ClF3O — CID 63988180

IUPAC(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol
SMILESOC(c1ccc(Cl)c(F)c1)c1cccc(F)c1F
InChIInChI=1S/C13H8ClF3O/c14-9-5-4-7(6-11(9)16)13(18)8-2-1-3-10(15)12(8)17/h1-6,13,18H
InChIKeyRDYZSWGKUWUZFY-UHFFFAOYSA-N
MW272.65 g/mol
LogP3.84
Rot. Bonds2

About (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol

(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol (PubChem CID 63988180) has the molecular formula C13H8ClF3O and a molecular weight of 272.65 g/mol. Its IUPAC name is (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol.

Molecular Properties

Compound Name(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol
PubChem CID63988180
Molecular FormulaC13H8ClF3O
Molecular Weight272.65 g/mol
Exact Mass272.02
IUPAC Name(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol
SMILESOC(c1ccc(Cl)c(F)c1)c1cccc(F)c1F
InChIInChI=1S/C13H8ClF3O/c14-9-5-4-7(6-11(9)16)13(18)8-2-1-3-10(15)12(8)17/h1-6,13,18H
InChIKeyRDYZSWGKUWUZFY-UHFFFAOYSA-N
XLogP3.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.65
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chloro-2-fluorophenyl)-(3,4-difluorophenyl)methanol
CID 64712600
(4-chloro-3-fluorophenyl)-(2-methylphenyl)methanol
CID 63895727
(2-chloro-4,5-dimethylphenyl)-(2,3-difluorophenyl)methanol
CID 115484592
(4-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 63895530
(2,3-difluorophenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63895919
(3,4-difluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477927
(2-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130732
(2,3-difluorophenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115800901
(3-bromo-4-methoxyphenyl)-(2,3-difluorophenyl)methanol
CID 62660225
(3,4-difluorophenyl)-(2,3,4-trifluorophenyl)methanol
CID 62965110
(3,4-difluorophenyl)-(2-fluorophenyl)methanol
CID 61088873
(4-chlorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477274

Frequently Asked Questions

What is the IUPAC name of (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol?
The IUPAC name of (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol (CID 63988180) is (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol.
What is the SMILES notation for (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol?
The canonical SMILES for (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol is OC(c1ccc(Cl)c(F)c1)c1cccc(F)c1F.
What is the InChIKey of (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol?
The InChIKey is RDYZSWGKUWUZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClF3O/c14-9-5-4-7(6-11(9)16)13(18)8-2-1-3-10(15)12(8)17/h1-6,13,18H.
What are the key properties of (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol?
(4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol has a molecular weight of 272.65 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-3-fluorophenyl)-(2,3-difluorophenyl)methanol is sourced from PubChem (CID 63988180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).