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

C8H7ClF2O — CID 178189080

IUPAC1-(2-chloro-4,6-difluorophenyl)ethanol
SMILESCC(O)c1c(F)cc(F)cc1Cl
InChIInChI=1S/C8H7ClF2O/c1-4(12)8-6(9)2-5(10)3-7(8)11/h2-4,12H,1H3
InChIKeyMMCZMRIIISVPMU-UHFFFAOYSA-N
MW192.59 g/mol
LogP2.67
Rot. Bonds1

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

1-(2-chloro-4,6-difluorophenyl)ethanol (PubChem CID 178189080) has the molecular formula C8H7ClF2O and a molecular weight of 192.59 g/mol. Its IUPAC name is 1-(2-chloro-4,6-difluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2-chloro-4,6-difluorophenyl)ethanol
PubChem CID178189080
Molecular FormulaC8H7ClF2O
Molecular Weight192.59 g/mol
Exact Mass192.02
IUPAC Name1-(2-chloro-4,6-difluorophenyl)ethanol
SMILESCC(O)c1c(F)cc(F)cc1Cl
InChIInChI=1S/C8H7ClF2O/c1-4(12)8-6(9)2-5(10)3-7(8)11/h2-4,12H,1H3
InChIKeyMMCZMRIIISVPMU-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.59
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2-chloro-4,6-difluorophenyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-1-(2,4,6-trifluorophenyl)propan-1-ol
CID 61087293
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089185
(1S)-1-(4-fluoro-2,6-dimethylphenyl)ethanol
CID 106880220
(2-chlorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089370
1,3,5-trifluoro-2-(3-methylbutan-2-yl)benzene
CID 76786505
1-(2,4,6-trifluorophenyl)propan-1-ol
CID 61087665
1-(3-chloro-2-fluoro-5,6-dimethylphenyl)ethanol
CID 117291204
1-(2-chloro-3-fluoro-5,6-dimethylphenyl)ethanol
CID 84671170
1-(5-chloro-2,4-difluorophenyl)ethanol
CID 117283331
(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 82883112
2-methyl-1-(2,4,6-trifluorophenyl)propan-1-amine
CID 43198662
2-(2-chlorophenyl)-1-(2,4,6-trifluorophenyl)ethanol
CID 61086934

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4,6-difluorophenyl)ethanol?
The IUPAC name of 1-(2-chloro-4,6-difluorophenyl)ethanol (CID 178189080) is 1-(2-chloro-4,6-difluorophenyl)ethanol.
What is the SMILES notation for 1-(2-chloro-4,6-difluorophenyl)ethanol?
The canonical SMILES for 1-(2-chloro-4,6-difluorophenyl)ethanol is CC(O)c1c(F)cc(F)cc1Cl.
What is the InChIKey of 1-(2-chloro-4,6-difluorophenyl)ethanol?
The InChIKey is MMCZMRIIISVPMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClF2O/c1-4(12)8-6(9)2-5(10)3-7(8)11/h2-4,12H,1H3.
What are the key properties of 1-(2-chloro-4,6-difluorophenyl)ethanol?
1-(2-chloro-4,6-difluorophenyl)ethanol has a molecular weight of 192.59 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4,6-difluorophenyl)ethanol is sourced from PubChem (CID 178189080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).