1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol

C14H10ClF3O — CID 64712609

IUPAC1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1F)c1cccc(Cl)c1F
InChIInChI=1S/C14H10ClF3O/c15-11-3-1-2-10(14(11)18)13(19)7-8-6-9(16)4-5-12(8)17/h1-6,13,19H,7H2
InChIKeyNWEZIBBCIHLXAJ-UHFFFAOYSA-N
MW286.68 g/mol
LogP4.03
Rot. Bonds3

About 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol

1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol (PubChem CID 64712609) has the molecular formula C14H10ClF3O and a molecular weight of 286.68 g/mol. Its IUPAC name is 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol.

Molecular Properties

Compound Name1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol
PubChem CID64712609
Molecular FormulaC14H10ClF3O
Molecular Weight286.68 g/mol
Exact Mass286.04
IUPAC Name1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1F)c1cccc(Cl)c1F
InChIInChI=1S/C14H10ClF3O/c15-11-3-1-2-10(14(11)18)13(19)7-8-6-9(16)4-5-12(8)17/h1-6,13,19H,7H2
InChIKeyNWEZIBBCIHLXAJ-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-(3-chloro-2-fluorophenyl)-2-(5-chloro-2-fluorophenyl)ethanol
CID 103047803
1-(2-chlorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 62099435
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 64714150
2-(2,5-difluorophenyl)-1-(2-fluorophenyl)ethanol
CID 63083872
1-(3-chloro-2-fluorophenyl)-2-(3,4-difluorophenyl)ethanol
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2-(2,5-difluorophenyl)-1-naphthalen-1-ylethanol
CID 62716051
1-(3-chloro-2-fluorophenyl)-2-(3-chlorophenyl)ethanol
CID 64712924
1-(3-chloro-2-fluorophenyl)-2-(2,6-difluorophenyl)ethanol
CID 81263148
1-(2-aminophenyl)-2-(2,5-difluorophenyl)ethanol
CID 64831592
2-(5-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 65148464
1-(3-chloro-2-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 107103532
1-(2-bromo-5-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102867515

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol?
The IUPAC name of 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol (CID 64712609) is 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol.
What is the SMILES notation for 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol?
The canonical SMILES for 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol is OC(Cc1cc(F)ccc1F)c1cccc(Cl)c1F.
What is the InChIKey of 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol?
The InChIKey is NWEZIBBCIHLXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF3O/c15-11-3-1-2-10(14(11)18)13(19)7-8-6-9(16)4-5-12(8)17/h1-6,13,19H,7H2.
What are the key properties of 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol?
1-(3-chloro-2-fluorophenyl)-2-(2,5-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 1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol is sourced from PubChem (CID 64712609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).