[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol

C14H12F2O — CID 175668235

IUPAC[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol
SMILESCc1ccc(-c2ccc(F)c(CO)c2F)cc1
InChIInChI=1S/C14H12F2O/c1-9-2-4-10(5-3-9)11-6-7-13(15)12(8-17)14(11)16/h2-7,17H,8H2,1H3
InChIKeyNDBWPGFRFYUOTI-UHFFFAOYSA-N
MW234.25 g/mol
LogP3.43
Rot. Bonds2

About [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol

[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol (PubChem CID 175668235) has the molecular formula C14H12F2O and a molecular weight of 234.25 g/mol. Its IUPAC name is [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol.

Molecular Properties

Compound Name[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol
PubChem CID175668235
Molecular FormulaC14H12F2O
Molecular Weight234.25 g/mol
Exact Mass234.09
IUPAC Name[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol
SMILESCc1ccc(-c2ccc(F)c(CO)c2F)cc1
InChIInChI=1S/C14H12F2O/c1-9-2-4-10(5-3-9)11-6-7-13(15)12(8-17)14(11)16/h2-7,17H,8H2,1H3
InChIKeyNDBWPGFRFYUOTI-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol?
The IUPAC name of [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol (CID 175668235) is [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol.
What is the SMILES notation for [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol?
The canonical SMILES for [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol is Cc1ccc(-c2ccc(F)c(CO)c2F)cc1.
What is the InChIKey of [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol?
The InChIKey is NDBWPGFRFYUOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2O/c1-9-2-4-10(5-3-9)11-6-7-13(15)12(8-17)14(11)16/h2-7,17H,8H2,1H3.
What are the key properties of [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol?
[2,6-difluoro-3-(4-methylphenyl)phenyl]methanol has a molecular weight of 234.25 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-difluoro-3-(4-methylphenyl)phenyl]methanol is sourced from PubChem (CID 175668235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).