1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol

C15H13F3O — CID 82815536

IUPAC1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol
SMILESCc1ccc(F)c(C(O)Cc2ccccc2F)c1F
InChIInChI=1S/C15H13F3O/c1-9-6-7-12(17)14(15(9)18)13(19)8-10-4-2-3-5-11(10)16/h2-7,13,19H,8H2,1H3
InChIKeyUWDIJTOAQRGYJH-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.69
Rot. Bonds3

About 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol

1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol (PubChem CID 82815536) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol
PubChem CID82815536
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol
SMILESCc1ccc(F)c(C(O)Cc2ccccc2F)c1F
InChIInChI=1S/C15H13F3O/c1-9-6-7-12(17)14(15(9)18)13(19)8-10-4-2-3-5-11(10)16/h2-7,13,19H,8H2,1H3
InChIKeyUWDIJTOAQRGYJH-UHFFFAOYSA-N
XLogP3.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-bromo-2-fluorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanol
CID 115788594
1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 82814752
1-(3-fluoro-4-methylphenyl)-2-(2-fluorophenyl)ethanol
CID 60798295
1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)sulfanylethanol
CID 82823028
2-(4-bromophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanol
CID 82815992
1-(2,6-dimethoxyphenyl)-2-(2-fluorophenyl)ethanol
CID 63018085
(2,6-difluoro-3-methylphenyl)-(2,6-difluorophenyl)methanol
CID 82820156
2-(5-bromo-2-methoxyphenyl)-1-(2,6-difluoro-3-methylphenyl)ethanol
CID 115779347
2-(2-fluorophenyl)-1-(5-methylfuran-2-yl)ethanol
CID 63016605
2-(3,4-dichlorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanol
CID 82816292
1-(2,6-difluoro-3-methylphenyl)-3-methylpentan-1-ol
CID 115789411
2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 82802615

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol?
The IUPAC name of 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol (CID 82815536) is 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol?
The canonical SMILES for 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol is Cc1ccc(F)c(C(O)Cc2ccccc2F)c1F.
What is the InChIKey of 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol?
The InChIKey is UWDIJTOAQRGYJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-9-6-7-12(17)14(15(9)18)13(19)8-10-4-2-3-5-11(10)16/h2-7,13,19H,8H2,1H3.
What are the key properties of 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol?
1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol has a molecular weight of 266.26 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol is sourced from PubChem (CID 82815536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).