2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol

C15H13ClF2O — CID 107883556

IUPAC2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
SMILESCc1cc(F)ccc1C(O)Cc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H13ClF2O/c1-9-6-11(17)3-4-12(9)15(19)8-10-2-5-13(16)14(18)7-10/h2-7,15,19H,8H2,1H3
InChIKeyXQEBTXKPUHOQFM-UHFFFAOYSA-N
MW282.72 g/mol
LogP4.20
Rot. Bonds3

About 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol

2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol (PubChem CID 107883556) has the molecular formula C15H13ClF2O and a molecular weight of 282.72 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
PubChem CID107883556
Molecular FormulaC15H13ClF2O
Molecular Weight282.72 g/mol
Exact Mass282.06
IUPAC Name2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
SMILESCc1cc(F)ccc1C(O)Cc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H13ClF2O/c1-9-6-11(17)3-4-12(9)15(19)8-10-2-5-13(16)14(18)7-10/h2-7,15,19H,8H2,1H3
InChIKeyXQEBTXKPUHOQFM-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-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 114012545
2-(4-chloro-3-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethanol
CID 107884336
2-(4-chloro-3-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 107883504
1-(2-chloro-5-fluorophenyl)-2-(3,4-difluorophenyl)ethanol
CID 105397725
2-(3,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607682
2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 107884328
2-(4-chloro-3-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 114012571
2-(4-tert-butylphenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 65150242
1-(5-bromo-2-chlorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894369
2-(4-chloro-3-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 107883521
1-(2-chloro-4,5-dimethylphenyl)-2-(3,4-difluorophenyl)ethanol
CID 115484531
1-(2-chloro-3-fluorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894454

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol (CID 107883556) is 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol is Cc1cc(F)ccc1C(O)Cc1ccc(Cl)c(F)c1.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol?
The InChIKey is XQEBTXKPUHOQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2O/c1-9-6-11(17)3-4-12(9)15(19)8-10-2-5-13(16)14(18)7-10/h2-7,15,19H,8H2,1H3.
What are the key properties of 2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol?
2-(4-chloro-3-fluorophenyl)-1-(4-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-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 107883556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).