2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol

C14H10ClF3O — CID 82802615

IUPAC2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
SMILESOC(Cc1cccc(Cl)c1F)c1c(F)cccc1F
InChIInChI=1S/C14H10ClF3O/c15-9-4-1-3-8(14(9)18)7-12(19)13-10(16)5-2-6-11(13)17/h1-6,12,19H,7H2
InChIKeyUHQFJECGOJWJJT-UHFFFAOYSA-N
MW286.68 g/mol
LogP4.03
Rot. Bonds3

About 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol

2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol (PubChem CID 82802615) has the molecular formula C14H10ClF3O and a molecular weight of 286.68 g/mol. Its IUPAC name is 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
PubChem CID82802615
Molecular FormulaC14H10ClF3O
Molecular Weight286.68 g/mol
Exact Mass286.04
IUPAC Name2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
SMILESOC(Cc1cccc(Cl)c1F)c1c(F)cccc1F
InChIInChI=1S/C14H10ClF3O/c15-9-4-1-3-8(14(9)18)7-12(19)13-10(16)5-2-6-11(13)17/h1-6,12,19H,7H2
InChIKeyUHQFJECGOJWJJT-UHFFFAOYSA-N
XLogP4.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.68
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102857500
2-(2-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 112653011
2-(3-chloro-2-fluorophenyl)-1-(2-fluorophenyl)ethanol
CID 82802842
2-(3-chloro-2-fluorophenyl)-1-(2,6-dimethoxyphenyl)ethanol
CID 116810239
1-(3-chloro-2-fluorophenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 82806467
1-(2-chloro-6-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
CID 114851983
2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol
CID 61086934
1-(3-bromo-2-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 106645174
1-(4-bromo-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102856976
1-(2-chloro-6-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 63016942
1-(3-chloro-2-fluorophenyl)-3-methylbutan-2-ol
CID 82803053
1-(3-chloro-2-fluorophenyl)butane-2,3-diol
CID 103452798

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The IUPAC name of 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol (CID 82802615) is 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol.
What is the SMILES notation for 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The canonical SMILES for 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol is OC(Cc1cccc(Cl)c1F)c1c(F)cccc1F.
What is the InChIKey of 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The InChIKey is UHQFJECGOJWJJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF3O/c15-9-4-1-3-8(14(9)18)7-12(19)13-10(16)5-2-6-11(13)17/h1-6,12,19H,7H2.
What are the key properties of 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol has a molecular weight of 286.68 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol is sourced from PubChem (CID 82802615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).