1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol

C15H13F3O — CID 107512082

IUPAC1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol
SMILESCc1ccc(C(C)(O)c2ccccc2F)c(F)c1F
InChIInChI=1S/C15H13F3O/c1-9-7-8-11(14(18)13(9)17)15(2,19)10-5-3-4-6-12(10)16/h3-8,19H,1-2H3
InChIKeyZEZWCUNWTOVXRV-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.67
Rot. Bonds2

About 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol

1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol (PubChem CID 107512082) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol
PubChem CID107512082
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol
SMILESCc1ccc(C(C)(O)c2ccccc2F)c(F)c1F
InChIInChI=1S/C15H13F3O/c1-9-7-8-11(14(18)13(9)17)15(2,19)10-5-3-4-6-12(10)16/h3-8,19H,1-2H3
InChIKeyZEZWCUNWTOVXRV-UHFFFAOYSA-N
XLogP3.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,3-difluorophenyl)-1-(2-methylphenyl)ethanol
CID 63988174
1-(2,4-dimethylphenyl)-1-(2-fluorophenyl)ethanol
CID 55120280
1-(2-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanol
CID 62802798
1-(2-fluorophenyl)-1-(4-methylphenyl)ethanol
CID 60793952
1-(3,5-difluorophenyl)-1-(2-fluorophenyl)ethanol
CID 55116357
1-(4-chlorophenyl)-1-(2-fluorophenyl)ethanol
CID 55026142
1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol
CID 79692201
1-(5-bromo-2-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 79743593
1-(2,6-difluoro-3-methylphenyl)-1-(2-fluorophenyl)ethanamine
CID 82819787
1-(5-fluoro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 82770802
2-(2,3-difluoro-4-methylphenyl)-2-methylpropan-1-ol
CID 117289363
1-(5-chloro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 62788121

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol?
The IUPAC name of 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol (CID 107512082) is 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol?
The canonical SMILES for 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol is Cc1ccc(C(C)(O)c2ccccc2F)c(F)c1F.
What is the InChIKey of 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol?
The InChIKey is ZEZWCUNWTOVXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-9-7-8-11(14(18)13(9)17)15(2,19)10-5-3-4-6-12(10)16/h3-8,19H,1-2H3.
What are the key properties of 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol?
1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol has a molecular weight of 266.26 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol is sourced from PubChem (CID 107512082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).