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

C13H9F3O — CID 61088873

IUPAC(3,4-difluorophenyl)-(2-fluorophenyl)methanol
SMILESOC(c1ccc(F)c(F)c1)c1ccccc1F
InChIInChI=1S/C13H9F3O/c14-10-4-2-1-3-9(10)13(17)8-5-6-11(15)12(16)7-8/h1-7,13,17H
InChIKeyRSOIBVUQZUHMPX-UHFFFAOYSA-N
MW238.21 g/mol
LogP3.19
Rot. Bonds2

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

(3,4-difluorophenyl)-(2-fluorophenyl)methanol (PubChem CID 61088873) has the molecular formula C13H9F3O and a molecular weight of 238.21 g/mol. Its IUPAC name is (3,4-difluorophenyl)-(2-fluorophenyl)methanol.

Molecular Properties

Compound Name(3,4-difluorophenyl)-(2-fluorophenyl)methanol
PubChem CID61088873
Molecular FormulaC13H9F3O
Molecular Weight238.21 g/mol
Exact Mass238.06
IUPAC Name(3,4-difluorophenyl)-(2-fluorophenyl)methanol
SMILESOC(c1ccc(F)c(F)c1)c1ccccc1F
InChIInChI=1S/C13H9F3O/c14-10-4-2-1-3-9(10)13(17)8-5-6-11(15)12(16)7-8/h1-7,13,17H
InChIKeyRSOIBVUQZUHMPX-UHFFFAOYSA-N
XLogP3.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.21
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287213
(3,4-difluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477927
bis(2-fluorophenyl)methanol
CID 18424663
(3-chloro-2-fluorophenyl)-(3,4-difluorophenyl)methanol
CID 64712600
(3,4-difluorophenyl)-(2,3-dimethylphenyl)methanol
CID 61088298
(3,4-difluorophenyl)-(2,3,4-trifluorophenyl)methanol
CID 62965110
(S)-(2-fluorophenyl)-pyridin-4-ylmethanol
CID 166771520
(3-bromo-4-fluorophenyl)-(2-bromophenyl)methanol
CID 79746626
[3-(difluoromethoxy)phenyl]-(2-fluorophenyl)methanol
CID 115781698
(2-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130732
[4-(2-aminoethyl)phenyl]-(2-fluorophenyl)methanol
CID 82026510
(3,4-difluorophenyl)-isoquinolin-5-ylmethanol
CID 62813501

Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-(2-fluorophenyl)methanol?
The IUPAC name of (3,4-difluorophenyl)-(2-fluorophenyl)methanol (CID 61088873) is (3,4-difluorophenyl)-(2-fluorophenyl)methanol.
What is the SMILES notation for (3,4-difluorophenyl)-(2-fluorophenyl)methanol?
The canonical SMILES for (3,4-difluorophenyl)-(2-fluorophenyl)methanol is OC(c1ccc(F)c(F)c1)c1ccccc1F.
What is the InChIKey of (3,4-difluorophenyl)-(2-fluorophenyl)methanol?
The InChIKey is RSOIBVUQZUHMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3O/c14-10-4-2-1-3-9(10)13(17)8-5-6-11(15)12(16)7-8/h1-7,13,17H.
What are the key properties of (3,4-difluorophenyl)-(2-fluorophenyl)methanol?
(3,4-difluorophenyl)-(2-fluorophenyl)methanol has a molecular weight of 238.21 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-(2-fluorophenyl)methanol is sourced from PubChem (CID 61088873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).