1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol

C14H10BrClF2O — CID 102857500

IUPAC1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
SMILESOC(Cc1cccc(Cl)c1F)c1c(F)cccc1Br
InChIInChI=1S/C14H10BrClF2O/c15-9-4-2-6-11(17)13(9)12(19)7-8-3-1-5-10(16)14(8)18/h1-6,12,19H,7H2
InChIKeyKCAMEKBWXCRGSI-UHFFFAOYSA-N
MW347.59 g/mol
LogP4.66
Rot. Bonds3

About 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol

1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol (PubChem CID 102857500) has the molecular formula C14H10BrClF2O and a molecular weight of 347.59 g/mol. Its IUPAC name is 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
PubChem CID102857500
Molecular FormulaC14H10BrClF2O
Molecular Weight347.59 g/mol
Exact Mass345.96
IUPAC Name1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
SMILESOC(Cc1cccc(Cl)c1F)c1c(F)cccc1Br
InChIInChI=1S/C14H10BrClF2O/c15-9-4-2-6-11(17)13(9)12(19)7-8-3-1-5-10(16)14(8)18/h1-6,12,19H,7H2
InChIKeyKCAMEKBWXCRGSI-UHFFFAOYSA-N
XLogP4.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.59
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)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-(3-chloro-2-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 82802615
2-(2-bromo-3-fluorophenyl)-1-(2-bromo-6-fluorophenyl)ethanol
CID 114885692
1-(3-bromo-2-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 106645174
1-(2-bromo-6-fluorophenyl)-2-(5-chloro-2-fluorophenyl)ethanol
CID 103048373
1-(4-bromo-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102856976
2-(3-chloro-2-fluorophenyl)-1-(2-fluorophenyl)ethanol
CID 82802842
2-(2-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 112653011
2-(3-chloro-2-fluorophenyl)-1-(2,6-dimethoxyphenyl)ethanol
CID 116810239
1-(3-chloro-2-fluorophenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 82806467
1-(2-bromo-5-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102867515
1-(3-bromo-2-fluorophenyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 107954110
1-(4-bromo-5-chlorothiophen-2-yl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102857075

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol?
The IUPAC name of 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol (CID 102857500) is 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol?
The canonical SMILES for 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol is OC(Cc1cccc(Cl)c1F)c1c(F)cccc1Br.
What is the InChIKey of 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol?
The InChIKey is KCAMEKBWXCRGSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClF2O/c15-9-4-2-6-11(17)13(9)12(19)7-8-3-1-5-10(16)14(8)18/h1-6,12,19H,7H2.
What are the key properties of 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol?
1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol has a molecular weight of 347.59 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-6-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol is sourced from PubChem (CID 102857500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).