2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol

C14H10BrCl2FO — CID 65150935

IUPAC2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1Br)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10BrCl2FO/c15-12-4-2-10(18)5-8(12)6-14(19)11-3-1-9(16)7-13(11)17/h1-5,7,14,19H,6H2
InChIKeyZWZUWLKPAXQBTH-UHFFFAOYSA-N
MW364.04 g/mol
LogP5.17
Rot. Bonds3

About 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol

2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol (PubChem CID 65150935) has the molecular formula C14H10BrCl2FO and a molecular weight of 364.04 g/mol. Its IUPAC name is 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol.

Molecular Properties

Compound Name2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
PubChem CID65150935
Molecular FormulaC14H10BrCl2FO
Molecular Weight364.04 g/mol
Exact Mass361.93
IUPAC Name2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
SMILESOC(Cc1cc(F)ccc1Br)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10BrCl2FO/c15-12-4-2-10(18)5-8(12)6-14(19)11-3-1-9(16)7-13(11)17/h1-5,7,14,19H,6H2
InChIKeyZWZUWLKPAXQBTH-UHFFFAOYSA-N
XLogP5.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.04
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-4-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
CID 65150787
2-(2-chloro-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol
CID 102617223
1-(5-bromo-2-chlorophenyl)-2-(2-bromo-5-fluorophenyl)ethanol
CID 115787558
1-(2-bromo-5-fluorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 115802037
1-(2-chlorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 62099435
1-(4-bromo-2-chlorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
CID 114852756
2-(2-chloro-5-fluorophenyl)-1-(2,4-dibromophenyl)ethanol
CID 107947895
1-(2-bromo-5-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102867515
1-(2-bromo-4-fluorophenyl)-2-(4-chlorophenyl)ethanol
CID 63016944
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanol
CID 64712609
2-(2-bromo-5-fluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)ethanol
CID 105088408
2-(2-bromo-4-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115787001

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol?
The IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol (CID 65150935) is 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol.
What is the SMILES notation for 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol?
The canonical SMILES for 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol is OC(Cc1cc(F)ccc1Br)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol?
The InChIKey is ZWZUWLKPAXQBTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2FO/c15-12-4-2-10(18)5-8(12)6-14(19)11-3-1-9(16)7-13(11)17/h1-5,7,14,19H,6H2.
What are the key properties of 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol?
2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol has a molecular weight of 364.04 g/mol, XLogP of 5.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-fluorophenyl)-1-(2,4-dichlorophenyl)ethanol is sourced from PubChem (CID 65150935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).