2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol

C14H10Br2F2O — CID 115826503

IUPAC2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol
SMILESOC(Cc1cccc(F)c1Br)c1cc(F)ccc1Br
InChIInChI=1S/C14H10Br2F2O/c15-11-5-4-9(17)7-10(11)13(19)6-8-2-1-3-12(18)14(8)16/h1-5,7,13,19H,6H2
InChIKeyFLURGDYUAOHZRW-UHFFFAOYSA-N
MW392.04 g/mol
LogP4.77
Rot. Bonds3

About 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol

2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol (PubChem CID 115826503) has the molecular formula C14H10Br2F2O and a molecular weight of 392.04 g/mol. Its IUPAC name is 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol
PubChem CID115826503
Molecular FormulaC14H10Br2F2O
Molecular Weight392.04 g/mol
Exact Mass389.91
IUPAC Name2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol
SMILESOC(Cc1cccc(F)c1Br)c1cc(F)ccc1Br
InChIInChI=1S/C14H10Br2F2O/c15-11-5-4-9(17)7-10(11)13(19)6-8-2-1-3-12(18)14(8)16/h1-5,7,13,19H,6H2
InChIKeyFLURGDYUAOHZRW-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

1-(2-bromo-5-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanol
CID 102867515
2-(2-bromo-3-fluorophenyl)-1-(2-bromo-6-fluorophenyl)ethanol
CID 114885692
2-(2-bromo-3-fluorophenyl)-1-(2-fluoro-4-methylphenyl)ethanol
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1-(2-bromo-5-fluorophenyl)-2-(2,5-dichlorophenyl)ethanol
CID 115802037
2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methoxyphenyl)ethanol
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2-(2-bromo-4-fluorophenyl)-1-(2-chloro-3-fluorophenyl)ethanol
CID 115786915
2-amino-1-(2-bromo-5-fluorophenyl)ethanol
CID 83714678
[2-(2-bromo-3-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105211530
(1S)-1-(2-bromo-5-fluorophenyl)propan-1-ol
CID 103920536
1-(3-bromo-2-fluorophenyl)-2-(2,4-difluorophenyl)ethanol
CID 106645063
1-(2,4-difluorophenyl)-2-(2-fluorophenyl)ethanol
CID 61086986
1-(2-bromo-5-fluorophenyl)hex-5-yn-1-ol
CID 115831811

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol?
The IUPAC name of 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol (CID 115826503) is 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol.
What is the SMILES notation for 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol?
The canonical SMILES for 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol is OC(Cc1cccc(F)c1Br)c1cc(F)ccc1Br.
What is the InChIKey of 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol?
The InChIKey is FLURGDYUAOHZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2F2O/c15-11-5-4-9(17)7-10(11)13(19)6-8-2-1-3-12(18)14(8)16/h1-5,7,13,19H,6H2.
What are the key properties of 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol?
2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)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 2-(2-bromo-3-fluorophenyl)-1-(2-bromo-5-fluorophenyl)ethanol is sourced from PubChem (CID 115826503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).