1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol

C15H14F2O — CID 62787951

IUPAC1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
SMILESCc1cc(C(C)(O)c2cccc(F)c2)ccc1F
InChIInChI=1S/C15H14F2O/c1-10-8-12(6-7-14(10)17)15(2,18)11-4-3-5-13(16)9-11/h3-9,18H,1-2H3
InChIKeyYENJYALPNQRCRY-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.53
Rot. Bonds2

About 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol

1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol (PubChem CID 62787951) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
PubChem CID62787951
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
SMILESCc1cc(C(C)(O)c2cccc(F)c2)ccc1F
InChIInChI=1S/C15H14F2O/c1-10-8-12(6-7-14(10)17)15(2,18)11-4-3-5-13(16)9-11/h3-9,18H,1-2H3
InChIKeyYENJYALPNQRCRY-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-fluorophenyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanol
CID 107287061
1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 62787437
1-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62787268
2-(4-fluoro-3-methylphenyl)propan-2-ol
CID 20785410
1-(3,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62786600
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
1-(2,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62801933
1-(3,4-dimethylphenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79692579
2-(4-fluoro-3-methylphenyl)-3-methylbutan-2-ol
CID 62786947
(2S)-2-(4-fluoro-3-methylphenyl)butan-2-ol
CID 94601210
(2R)-2-(4-fluoro-3-methylphenyl)butan-2-ol
CID 94601211
1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol
CID 62801185

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol?
The IUPAC name of 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol (CID 62787951) is 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol.
What is the SMILES notation for 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol?
The canonical SMILES for 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol is Cc1cc(C(C)(O)c2cccc(F)c2)ccc1F.
What is the InChIKey of 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol?
The InChIKey is YENJYALPNQRCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-10-8-12(6-7-14(10)17)15(2,18)11-4-3-5-13(16)9-11/h3-9,18H,1-2H3.
What are the key properties of 1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol?
1-(4-fluoro-3-methylphenyl)-1-(3-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-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol is sourced from PubChem (CID 62787951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).