2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol

C14H10Cl3FO — CID 107883512

IUPAC2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)c(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl3FO/c15-10-5-4-8(6-12(10)18)7-13(19)9-2-1-3-11(16)14(9)17/h1-6,13,19H,7H2
InChIKeyMPTAMJMKTYBQQP-UHFFFAOYSA-N
MW319.59 g/mol
LogP5.06
Rot. Bonds3

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

2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol (PubChem CID 107883512) has the molecular formula C14H10Cl3FO and a molecular weight of 319.59 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
PubChem CID107883512
Molecular FormulaC14H10Cl3FO
Molecular Weight319.59 g/mol
Exact Mass317.98
IUPAC Name2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
SMILESOC(Cc1ccc(Cl)c(F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl3FO/c15-10-5-4-8(6-12(10)18)7-13(19)9-2-1-3-11(16)14(9)17/h1-6,13,19H,7H2
InChIKeyMPTAMJMKTYBQQP-UHFFFAOYSA-N
XLogP5.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.59
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)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

1-(2-chloro-3-fluorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894454
2-(4-chloro-3-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 107883504
2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 114012545
2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 107883519
1-(3-chloro-2-fluorophenyl)-2-(3,4-difluorophenyl)ethanol
CID 81263221
1-(2,3-dichlorophenyl)-2-(3-methylphenyl)ethanol
CID 62792001
1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol
CID 62790994
1-(5-bromo-2-chlorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894369
2-(3-chloro-4-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 103038949
2-(5-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 65148464
(1R)-1-(2,3-dichlorophenyl)-2-pyridin-4-ylethanol
CID 129368105
1-(2,3-dichlorophenyl)-2-(2,4-dichlorophenyl)ethanol
CID 55187922

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol (CID 107883512) is 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol is OC(Cc1ccc(Cl)c(F)c1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol?
The InChIKey is MPTAMJMKTYBQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3FO/c15-10-5-4-8(6-12(10)18)7-13(19)9-2-1-3-11(16)14(9)17/h1-6,13,19H,7H2.
What are the key properties of 2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol?
2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol has a molecular weight of 319.59 g/mol, XLogP of 5.06, 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-(2,3-dichlorophenyl)ethanol is sourced from PubChem (CID 107883512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).