(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol

C13H9ClF2O — CID 63896004

IUPAC(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol
SMILESOC(c1cccc(F)c1)c1c(F)cccc1Cl
InChIInChI=1S/C13H9ClF2O/c14-10-5-2-6-11(16)12(10)13(17)8-3-1-4-9(15)7-8/h1-7,13,17H
InChIKeyYIVJZOWMVMFVSQ-UHFFFAOYSA-N
MW254.66 g/mol
LogP3.70
Rot. Bonds2

About (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol

(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol (PubChem CID 63896004) has the molecular formula C13H9ClF2O and a molecular weight of 254.66 g/mol. Its IUPAC name is (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol
PubChem CID63896004
Molecular FormulaC13H9ClF2O
Molecular Weight254.66 g/mol
Exact Mass254.03
IUPAC Name(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol
SMILESOC(c1cccc(F)c1)c1c(F)cccc1Cl
InChIInChI=1S/C13H9ClF2O/c14-10-5-2-6-11(16)12(10)13(17)8-3-1-4-9(15)7-8/h1-7,13,17H
InChIKeyYIVJZOWMVMFVSQ-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.66
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
CID 7153378
(2-chloro-6-fluorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879542
(2-chloro-6-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61082454
(2-chloro-6-fluorophenyl)-(2,4-dichlorophenyl)methanol
CID 61271392
(2,6-dichlorophenyl)-(3-fluoro-5-methylphenyl)methanol
CID 79690334
(3-bromo-4-methoxyphenyl)-(2-chloro-6-fluorophenyl)methanol
CID 61100995
(3-chlorophenyl)-(2,6-dichlorophenyl)methanol
CID 63894270
(R)-(3-chloro-5-fluorophenyl)-(3-fluorophenyl)methanol
CID 7146499
(4-bromo-5-chloro-2-fluorophenyl)-(3-fluorophenyl)methanol
CID 105399342
3-amino-2-(2-chloro-6-fluorophenyl)-1-(3,5-difluorophenyl)propan-1-ol
CID 65186627
(5-bromo-2-fluorophenyl)-(2-chloro-6-fluorophenyl)methanol
CID 79743340
(2-chloro-6-fluorophenyl)-(2,6-difluoro-4-methoxyphenyl)methanol
CID 61099448

Frequently Asked Questions

What is the IUPAC name of (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol?
The IUPAC name of (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol (CID 63896004) is (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol.
What is the SMILES notation for (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol?
The canonical SMILES for (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol is OC(c1cccc(F)c1)c1c(F)cccc1Cl.
What is the InChIKey of (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol?
The InChIKey is YIVJZOWMVMFVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2O/c14-10-5-2-6-11(16)12(10)13(17)8-3-1-4-9(15)7-8/h1-7,13,17H.
What are the key properties of (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol?
(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol has a molecular weight of 254.66 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol is sourced from PubChem (CID 63896004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).