1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol

C15H13F3O — CID 105372805

IUPAC1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1CC(O)c1ccc(F)c(F)c1
InChIInChI=1S/C15H13F3O/c1-9-2-4-12(16)6-11(9)8-15(19)10-3-5-13(17)14(18)7-10/h2-7,15,19H,8H2,1H3
InChIKeyJDPAODZTTQFKBP-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.69
Rot. Bonds3

About 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol

1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol (PubChem CID 105372805) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
PubChem CID105372805
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1CC(O)c1ccc(F)c(F)c1
InChIInChI=1S/C15H13F3O/c1-9-2-4-12(16)6-11(9)8-15(19)10-3-5-13(17)14(18)7-10/h2-7,15,19H,8H2,1H3
InChIKeyJDPAODZTTQFKBP-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-(5-fluoro-2-methylphenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 105372798
1-(4-bromo-3-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372954
1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373640
1-(4-tert-butylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372779
2-(2,5-dimethylphenyl)-1-(4-fluoro-3-methylphenyl)ethanol
CID 61482044
1-(3-chloro-5-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105377706
1-(4-chloro-3-methylphenyl)-2-(2,5-difluorophenyl)ethanol
CID 114982155
1-(2,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372816
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372772
1-(3,4-difluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 61089068
1-(3-bromo-4-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346820
1-(3-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373495

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol (CID 105372805) is 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol is Cc1ccc(F)cc1CC(O)c1ccc(F)c(F)c1.
What is the InChIKey of 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol?
The InChIKey is JDPAODZTTQFKBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-9-2-4-12(16)6-11(9)8-15(19)10-3-5-13(17)14(18)7-10/h2-7,15,19H,8H2,1H3.
What are the key properties of 1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol?
1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)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-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 105372805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).