(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol

C14H11F3O — CID 62802735

IUPAC(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCc1cc(C(O)c2cc(F)ccc2F)ccc1F
InChIInChI=1S/C14H11F3O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3
InChIKeyIJBQOFJYYDEYCO-UHFFFAOYSA-N
MW252.23 g/mol
LogP3.49
Rot. Bonds2

About (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol

(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol (PubChem CID 62802735) has the molecular formula C14H11F3O and a molecular weight of 252.23 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
PubChem CID62802735
Molecular FormulaC14H11F3O
Molecular Weight252.23 g/mol
Exact Mass252.08
IUPAC Name(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCc1cc(C(O)c2cc(F)ccc2F)ccc1F
InChIInChI=1S/C14H11F3O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3
InChIKeyIJBQOFJYYDEYCO-UHFFFAOYSA-N
XLogP3.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.23
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989
(3-fluoro-4-methylphenyl)-(5-fluoro-2-methylphenyl)methanol
CID 62789611
(4-chlorophenyl)-(5-fluoro-2-methylphenyl)methanol
CID 55133948
(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843
(2-chloro-4,5-dimethylphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 115484419
3-amino-2-(2,4-difluorophenyl)-1-(4-fluoro-3-methylphenyl)propan-1-ol
CID 65189770
(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
CID 107955698
(4-chloro-3-methylphenyl)-(5-fluoro-2-methylphenyl)methanol
CID 115793761
(5-bromo-2-fluorophenyl)-(4-bromo-3-methylphenyl)methanol
CID 81447497
(4-bromo-5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 105399490
(4-fluoro-3-methylphenyl)methanediol
CID 45090626

Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The IUPAC name of (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol (CID 62802735) is (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol.
What is the SMILES notation for (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The canonical SMILES for (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol is Cc1cc(C(O)c2cc(F)ccc2F)ccc1F.
What is the InChIKey of (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
The InChIKey is IJBQOFJYYDEYCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3O/c1-8-6-9(2-4-12(8)16)14(18)11-7-10(15)3-5-13(11)17/h2-7,14,18H,1H3.
What are the key properties of (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol?
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol has a molecular weight of 252.23 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol is sourced from PubChem (CID 62802735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).