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

C15H13BrF2O — CID 79702038

IUPAC2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)Cc1cc(F)cc(Br)c1
InChIInChI=1S/C15H13BrF2O/c1-9-2-3-12(17)8-14(9)15(19)6-10-4-11(16)7-13(18)5-10/h2-5,7-8,15,19H,6H2,1H3
InChIKeyTUMFVOZWGRIFJA-UHFFFAOYSA-N
MW327.17 g/mol
LogP4.31
Rot. Bonds3

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

2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol (PubChem CID 79702038) has the molecular formula C15H13BrF2O and a molecular weight of 327.17 g/mol. Its IUPAC name is 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
PubChem CID79702038
Molecular FormulaC15H13BrF2O
Molecular Weight327.17 g/mol
Exact Mass326.01
IUPAC Name2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)Cc1cc(F)cc(Br)c1
InChIInChI=1S/C15H13BrF2O/c1-9-2-3-12(17)8-14(9)15(19)6-10-4-11(16)7-13(18)5-10/h2-5,7-8,15,19H,6H2,1H3
InChIKeyTUMFVOZWGRIFJA-UHFFFAOYSA-N
XLogP4.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.17
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-bromo-5-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 79702447
2-(3-bromophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 55135398
2-(3-bromo-5-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanol
CID 115822786
2-(3-bromo-5-fluorophenyl)-1-(2-chloro-3-methylphenyl)ethanol
CID 115822817
2-(3-bromo-5-fluorophenyl)-1-(2-methylfuran-3-yl)ethanol
CID 113453302
2-(3-bromo-5-fluorophenyl)-1-(5-bromo-2-methylphenyl)ethanamine
CID 105015800
1-(2-bromo-5-fluorophenyl)-2-(3,4-dimethylphenyl)ethanol
CID 63018417
2-(3,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607682
2-(3-bromo-5-fluorophenyl)-1-(2-tert-butylphenyl)ethanol
CID 115822740
1-(3-bromo-5-fluorophenyl)-3-(4-fluorophenyl)propan-2-ol
CID 79701664
2-(3-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethanol
CID 79703067
1-(3-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373495

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol (CID 79702038) is 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol is Cc1ccc(F)cc1C(O)Cc1cc(F)cc(Br)c1.
What is the InChIKey of 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
The InChIKey is TUMFVOZWGRIFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2O/c1-9-2-3-12(17)8-14(9)15(19)6-10-4-11(16)7-13(18)5-10/h2-5,7-8,15,19H,6H2,1H3.
What are the key properties of 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol?
2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol has a molecular weight of 327.17 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-5-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 79702038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).