1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol

C15H14F2O — CID 62801185

IUPAC1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(C)(O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C15H14F2O/c1-10-3-5-11(6-4-10)15(2,18)12-7-8-13(16)14(17)9-12/h3-9,18H,1-2H3
InChIKeyKICBYNWFZOGXFQ-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.53
Rot. Bonds2

About 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol

1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol (PubChem CID 62801185) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol
PubChem CID62801185
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(C)(O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C15H14F2O/c1-10-3-5-11(6-4-10)15(2,18)12-7-8-13(16)14(17)9-12/h3-9,18H,1-2H3
InChIKeyKICBYNWFZOGXFQ-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-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylphenyl)ethanol
CID 107287051
1-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)ethanol
CID 107287052
1-(4-chlorophenyl)-1-(4-methylphenyl)ethanol
CID 60794087
1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
CID 79691276
1-(2-fluorophenyl)-1-(4-methylphenyl)ethanol
CID 60793952
2-(3,4-difluorophenyl)-3-methylbutan-2-ol
CID 62802016
2-(3,4-difluorophenyl)-2-hydroxypropanoic acid
CID 61237250
1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
CID 62787951
1-(4-bromo-3-fluorophenyl)-1-phenylethanol
CID 66915422
1-cyclopropyl-1-(3,4-difluorophenyl)ethanol
CID 62802186
2-(4-fluoro-3-methylphenyl)propan-2-ol
CID 20785410
1-(3,4-dimethylphenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79692579

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol?
The IUPAC name of 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol (CID 62801185) is 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol?
The canonical SMILES for 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol is Cc1ccc(C(C)(O)c2ccc(F)c(F)c2)cc1.
What is the InChIKey of 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol?
The InChIKey is KICBYNWFZOGXFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-10-3-5-11(6-4-10)15(2,18)12-7-8-13(16)14(17)9-12/h3-9,18H,1-2H3.
What are the key properties of 1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol?
1-(3,4-difluorophenyl)-1-(4-methylphenyl)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-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 62801185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).