1-[4-(difluoromethyl)phenyl]-2-phenylethanol

C15H14F2O — CID 115524931

IUPAC1-[4-(difluoromethyl)phenyl]-2-phenylethanol
SMILESOC(Cc1ccccc1)c1ccc(C(F)F)cc1
InChIInChI=1S/C15H14F2O/c16-15(17)13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h1-9,14-15,18H,10H2
InChIKeyWXLCWHPJMTVMII-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.90
Rot. Bonds4

About 1-[4-(difluoromethyl)phenyl]-2-phenylethanol

1-[4-(difluoromethyl)phenyl]-2-phenylethanol (PubChem CID 115524931) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1-[4-(difluoromethyl)phenyl]-2-phenylethanol.

Molecular Properties

Compound Name1-[4-(difluoromethyl)phenyl]-2-phenylethanol
PubChem CID115524931
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1-[4-(difluoromethyl)phenyl]-2-phenylethanol
SMILESOC(Cc1ccccc1)c1ccc(C(F)F)cc1
InChIInChI=1S/C15H14F2O/c16-15(17)13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h1-9,14-15,18H,10H2
InChIKeyWXLCWHPJMTVMII-UHFFFAOYSA-N
XLogP3.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1,2-diphenylethanol
CID 1379022
1-[3-(difluoromethyl)phenyl]-2-phenylethanol
CID 115527640
1-(4-chlorophenyl)-2-phenylethanol
CID 10966396
1-[4-(difluoromethyl)phenyl]-2-pyridin-3-ylethanol
CID 104735818
(1R)-2-(4-fluorophenyl)-1-phenylethanol
CID 93312313
(1R)-1-fluoro-2-phenylethanol
CID 163366132
1-[4-(difluoromethyl)phenyl]-2-(2-methoxyphenyl)ethanol
CID 115524903
1-naphthalen-2-yl-2-phenylethanol
CID 2793947
(1R)-1-[4-(diethoxymethyl)phenyl]-2-phenylethanol
CID 125466229
1-(4-methylsulfonylphenyl)-2-phenylethanol
CID 19073233
1,1-difluoro-3-phenylpropan-2-ol
CID 15085378
[fluoro(fluoro)methyl]benzene
CID 146164458

Frequently Asked Questions

What is the IUPAC name of 1-[4-(difluoromethyl)phenyl]-2-phenylethanol?
The IUPAC name of 1-[4-(difluoromethyl)phenyl]-2-phenylethanol (CID 115524931) is 1-[4-(difluoromethyl)phenyl]-2-phenylethanol.
What is the SMILES notation for 1-[4-(difluoromethyl)phenyl]-2-phenylethanol?
The canonical SMILES for 1-[4-(difluoromethyl)phenyl]-2-phenylethanol is OC(Cc1ccccc1)c1ccc(C(F)F)cc1.
What is the InChIKey of 1-[4-(difluoromethyl)phenyl]-2-phenylethanol?
The InChIKey is WXLCWHPJMTVMII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c16-15(17)13-8-6-12(7-9-13)14(18)10-11-4-2-1-3-5-11/h1-9,14-15,18H,10H2.
What are the key properties of 1-[4-(difluoromethyl)phenyl]-2-phenylethanol?
1-[4-(difluoromethyl)phenyl]-2-phenylethanol has a molecular weight of 248.27 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(difluoromethyl)phenyl]-2-phenylethanol is sourced from PubChem (CID 115524931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).