2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol

C14H10ClF3O — CID 61086934

IUPAC2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol
SMILESOC(Cc1ccccc1Cl)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10ClF3O/c15-10-4-2-1-3-8(10)5-13(19)14-11(17)6-9(16)7-12(14)18/h1-4,6-7,13,19H,5H2
InChIKeyNIMQJCJDDRBFNQ-UHFFFAOYSA-N
MW286.68 g/mol
LogP4.03
Rot. Bonds3

About 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol

2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol (PubChem CID 61086934) has the molecular formula C14H10ClF3O and a molecular weight of 286.68 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol
PubChem CID61086934
Molecular FormulaC14H10ClF3O
Molecular Weight286.68 g/mol
Exact Mass286.04
IUPAC Name2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol
SMILESOC(Cc1ccccc1Cl)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10ClF3O/c15-10-4-2-1-3-8(10)5-13(19)14-11(17)6-9(16)7-12(14)18/h1-4,6-7,13,19H,5H2
InChIKeyNIMQJCJDDRBFNQ-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

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CID 63430256
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(1R)-1,2-bis(2-chlorophenyl)ethanol
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CID 61089370
2-(2-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 112653011
1-(2,6-dichlorophenyl)-2-(2-methylphenyl)ethanol
CID 63016225
2-(2-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanol
CID 61080545
2-(2,5-dimethylphenyl)-1-(2,4,6-trifluorophenyl)ethanol
CID 62538036
1-(2-chlorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 62099435
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CID 65152747

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol?
The IUPAC name of 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol (CID 61086934) is 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol?
The canonical SMILES for 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol is OC(Cc1ccccc1Cl)c1c(F)cc(F)cc1F.
What is the InChIKey of 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol?
The InChIKey is NIMQJCJDDRBFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF3O/c15-10-4-2-1-3-8(10)5-13(19)14-11(17)6-9(16)7-12(14)18/h1-4,6-7,13,19H,5H2.
What are the key properties of 2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol?
2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)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-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol is sourced from PubChem (CID 61086934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).