2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol

C14H10ClF3O — CID 107883519

IUPAC2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)c(F)c1)c1c(F)cccc1F
InChIInChI=1S/C14H10ClF3O/c15-9-5-4-8(6-12(9)18)7-13(19)14-10(16)2-1-3-11(14)17/h1-6,13,19H,7H2
InChIKeyLXFFUTPUGMWEBU-UHFFFAOYSA-N
MW286.68 g/mol
LogP4.03
Rot. Bonds3

About 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol

2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol (PubChem CID 107883519) has the molecular formula C14H10ClF3O and a molecular weight of 286.68 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
PubChem CID107883519
Molecular FormulaC14H10ClF3O
Molecular Weight286.68 g/mol
Exact Mass286.04
IUPAC Name2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)c(F)c1)c1c(F)cccc1F
InChIInChI=1S/C14H10ClF3O/c15-9-5-4-8(6-12(9)18)7-13(19)14-10(16)2-1-3-11(14)17/h1-6,13,19H,7H2
InChIKeyLXFFUTPUGMWEBU-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-chloro-3-fluorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894454
2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 107883512
2-(4-chloro-3-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 107883521
2-(4-chloro-3-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 107883504
1-(2-chloro-6-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 63016942
1-(3-bromophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107883507
[2-(4-chloro-3-fluorophenyl)-1-(2,6-dichlorophenyl)ethyl]hydrazine
CID 107895613
2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 114012545
1-(4-bromophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107883490
2-(4-chloro-3-fluorophenyl)-1-(3-chloro-2-pyridinyl)ethanol
CID 107884392
2-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 82802615
[2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 107895230

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol (CID 107883519) is 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol is OC(Cc1ccc(Cl)c(F)c1)c1c(F)cccc1F.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
The InChIKey is LXFFUTPUGMWEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF3O/c15-9-5-4-8(6-12(9)18)7-13(19)14-10(16)2-1-3-11(14)17/h1-6,13,19H,7H2.
What are the key properties of 2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol?
2-(4-chloro-3-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-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol is sourced from PubChem (CID 107883519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).