1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol

C14H10Br2F2O — CID 107947331

IUPAC1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol
SMILESOC(Cc1ccc(F)cc1F)c1ccc(Br)cc1Br
InChIInChI=1S/C14H10Br2F2O/c15-9-2-4-11(12(16)6-9)14(19)5-8-1-3-10(17)7-13(8)18/h1-4,6-7,14,19H,5H2
InChIKeyKNHUMMLTRLCCEL-UHFFFAOYSA-N
MW392.04 g/mol
LogP4.77
Rot. Bonds3

About 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol

1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol (PubChem CID 107947331) has the molecular formula C14H10Br2F2O and a molecular weight of 392.04 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol
PubChem CID107947331
Molecular FormulaC14H10Br2F2O
Molecular Weight392.04 g/mol
Exact Mass389.91
IUPAC Name1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol
SMILESOC(Cc1ccc(F)cc1F)c1ccc(Br)cc1Br
InChIInChI=1S/C14H10Br2F2O/c15-9-2-4-11(12(16)6-9)14(19)5-8-1-3-10(17)7-13(8)18/h1-4,6-7,14,19H,5H2
InChIKeyKNHUMMLTRLCCEL-UHFFFAOYSA-N
XLogP4.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.04
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chloro-5-fluorophenyl)-1-(2,4-dibromophenyl)ethanol
CID 107947895
1-(2,4-dibromophenyl)-2-(4-fluorophenyl)ethanol
CID 107947257
2-(4-bromo-2-fluorophenyl)-1-(2,5-dibromophenyl)ethanol
CID 115788510
1-(3-bromo-2-fluorophenyl)-2-(2,4-difluorophenyl)ethanol
CID 106645063
1-(2-bromo-4-fluorophenyl)-2-(5-bromo-2-methoxyphenyl)ethanol
CID 115779284
1-(3-bromo-2-fluorophenyl)-2-(4-bromo-2-fluorophenyl)ethanol
CID 107954007
1-(4-bromo-2-chlorophenyl)-2-(4-chloro-2-fluorophenyl)ethanol
CID 114852756
2-(4-bromo-2-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 62606952
1-(2-bromo-4-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105377660
[2-(4-bromo-2-fluorophenyl)-1-(2,4-dibromophenyl)ethyl]hydrazine
CID 107948139
1-(2-bromo-3-methylphenyl)-2-(2,4-difluorophenyl)ethanol
CID 107983845
1-(2-bromo-4-fluorophenyl)-3-(2,4-difluorophenyl)propan-2-ol
CID 64561385

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol?
The IUPAC name of 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol (CID 107947331) is 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol.
What is the SMILES notation for 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol?
The canonical SMILES for 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol is OC(Cc1ccc(F)cc1F)c1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol?
The InChIKey is KNHUMMLTRLCCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2F2O/c15-9-2-4-11(12(16)6-9)14(19)5-8-1-3-10(17)7-13(8)18/h1-4,6-7,14,19H,5H2.
What are the key properties of 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol?
1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol has a molecular weight of 392.04 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-2-(2,4-difluorophenyl)ethanol is sourced from PubChem (CID 107947331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).