1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol

C15H14F2O — CID 79692201

IUPAC1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol
SMILESCc1cc(F)cc(C(C)(O)c2ccccc2F)c1
InChIInChI=1S/C15H14F2O/c1-10-7-11(9-12(16)8-10)15(2,18)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3
InChIKeyVWQHJMOXFJNHBQ-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.53
Rot. Bonds2

About 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol

1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol (PubChem CID 79692201) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol
PubChem CID79692201
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol
SMILESCc1cc(F)cc(C(C)(O)c2ccccc2F)c1
InChIInChI=1S/C15H14F2O/c1-10-7-11(9-12(16)8-10)15(2,18)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3
InChIKeyVWQHJMOXFJNHBQ-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,5-difluorophenyl)-1-(2-fluorophenyl)ethanol
CID 55116357
1-(2-bromophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79690330
1-(2-fluorophenyl)-1-(4-methylphenyl)ethanol
CID 60793952
1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
CID 79691276
1-(4-chlorophenyl)-1-(2-fluorophenyl)ethanol
CID 55026142
1-(2,4-dimethylphenyl)-1-(2-fluorophenyl)ethanol
CID 55120280
1-(3,4-dimethylphenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79692579
1-(3,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62786600
1-(2,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62801933
1-(2-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanol
CID 62802798
1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol
CID 107512082
2-(3-fluoro-5-methylphenyl)-3,3-dimethylbutan-2-ol
CID 115401195

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol?
The IUPAC name of 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol (CID 79692201) is 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol?
The canonical SMILES for 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol is Cc1cc(F)cc(C(C)(O)c2ccccc2F)c1.
What is the InChIKey of 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol?
The InChIKey is VWQHJMOXFJNHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-10-7-11(9-12(16)8-10)15(2,18)13-5-3-4-6-14(13)17/h3-9,18H,1-2H3.
What are the key properties of 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol?
1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol has a molecular weight of 248.27 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol is sourced from PubChem (CID 79692201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).