2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol

C15H13ClF2O — CID 103048202

IUPAC2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)Cc1cc(Cl)ccc1F
InChIInChI=1S/C15H13ClF2O/c1-9-2-4-12(17)8-13(9)15(19)7-10-6-11(16)3-5-14(10)18/h2-6,8,15,19H,7H2,1H3
InChIKeyASHVXBQSLXJSPM-UHFFFAOYSA-N
MW282.72 g/mol
LogP4.20
Rot. Bonds3

About 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol

2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol (PubChem CID 103048202) has the molecular formula C15H13ClF2O and a molecular weight of 282.72 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
PubChem CID103048202
Molecular FormulaC15H13ClF2O
Molecular Weight282.72 g/mol
Exact Mass282.06
IUPAC Name2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)Cc1cc(Cl)ccc1F
InChIInChI=1S/C15H13ClF2O/c1-9-2-4-12(17)8-13(9)15(19)7-10-6-11(16)3-5-14(10)18/h2-6,8,15,19H,7H2,1H3
InChIKeyASHVXBQSLXJSPM-UHFFFAOYSA-N
XLogP4.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.72
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607142
2-(2-chloro-4-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607143
2-(2-bromo-4-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115787001
2-(3-chlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62387586
2-(2-chloro-4-methylphenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 106867292
2-(5-chloro-2-methoxyphenyl)-1-(2,5-difluorophenyl)ethanol
CID 63661823
2-(5-bromo-2-fluorophenyl)-1-(5-bromo-2-methylphenyl)ethanol
CID 115784822
2-(2-chloro-3-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115831225
2-(4-chloro-2-fluorophenyl)-1-(2,5-difluorophenyl)ethanol
CID 114852109
2-(3,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607682
2-(2-chloro-6-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62388239
1-(2-chlorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 62099435

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol (CID 103048202) is 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol is Cc1ccc(F)cc1C(O)Cc1cc(Cl)ccc1F.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The InChIKey is ASHVXBQSLXJSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2O/c1-9-2-4-12(17)8-13(9)15(19)7-10-6-11(16)3-5-14(10)18/h2-6,8,15,19H,7H2,1H3.
What are the key properties of 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol has a molecular weight of 282.72 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 103048202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).