2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol

C15H14BrFO — CID 62608724

IUPAC2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(O)Cc2cc(F)ccc2Br)cc1
InChIInChI=1S/C15H14BrFO/c1-10-2-4-11(5-3-10)15(18)9-12-8-13(17)6-7-14(12)16/h2-8,15,18H,9H2,1H3
InChIKeyVEGCQDVTLNBYQC-UHFFFAOYSA-N
MW309.18 g/mol
LogP4.17
Rot. Bonds3

About 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol

2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol (PubChem CID 62608724) has the molecular formula C15H14BrFO and a molecular weight of 309.18 g/mol. Its IUPAC name is 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol
PubChem CID62608724
Molecular FormulaC15H14BrFO
Molecular Weight309.18 g/mol
Exact Mass308.02
IUPAC Name2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(O)Cc2cc(F)ccc2Br)cc1
InChIInChI=1S/C15H14BrFO/c1-10-2-4-11(5-3-10)15(18)9-12-8-13(17)6-7-14(12)16/h2-8,15,18H,9H2,1H3
InChIKeyVEGCQDVTLNBYQC-UHFFFAOYSA-N
XLogP4.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.18
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-5-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 65148021
2-(2-bromo-5-fluorophenyl)-1-(4-ethoxyphenyl)ethanol
CID 65146117
1-(4-bromo-3-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
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2-(2-bromo-5-fluorophenyl)-1-(3-bromophenyl)ethanol
CID 62606497
2-(2-bromo-5-fluorophenyl)-1-(5-methylfuran-2-yl)ethanol
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2-(5-fluoro-2-methylphenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 105372798
1-(3-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373495
2-(2-fluoro-3-methoxyphenyl)-1-(4-methylphenyl)ethanol
CID 104793076
1-(3-bromo-4-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346820
2-[(2-bromo-5-fluorophenyl)methyl]-3-(4-methylphenyl)propanoic acid
CID 60794341
2-(2-bromo-5-fluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)ethanol
CID 105088408
2-(2-bromo-4-fluorophenyl)-1-(2,4-dimethylphenyl)ethanol
CID 65148185

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol?
The IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol (CID 62608724) is 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol?
The canonical SMILES for 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol is Cc1ccc(C(O)Cc2cc(F)ccc2Br)cc1.
What is the InChIKey of 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol?
The InChIKey is VEGCQDVTLNBYQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrFO/c1-10-2-4-11(5-3-10)15(18)9-12-8-13(17)6-7-14(12)16/h2-8,15,18H,9H2,1H3.
What are the key properties of 2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol?
2-(2-bromo-5-fluorophenyl)-1-(4-methylphenyl)ethanol has a molecular weight of 309.18 g/mol, XLogP of 4.17, 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-(4-methylphenyl)ethanol is sourced from PubChem (CID 62608724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).