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

C15H14BrFO2 — CID 79743336

IUPAC1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1cc(Br)ccc1F
InChIInChI=1S/C15H14BrFO2/c1-15(18,11-5-3-4-6-14(11)19-2)12-9-10(16)7-8-13(12)17/h3-9,18H,1-2H3
InChIKeySMYMNMHNFCRFJA-UHFFFAOYSA-N
MW325.18 g/mol
LogP3.85
Rot. Bonds3

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

1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol (PubChem CID 79743336) has the molecular formula C15H14BrFO2 and a molecular weight of 325.18 g/mol. Its IUPAC name is 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
PubChem CID79743336
Molecular FormulaC15H14BrFO2
Molecular Weight325.18 g/mol
Exact Mass324.02
IUPAC Name1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1C(C)(O)c1cc(Br)ccc1F
InChIInChI=1S/C15H14BrFO2/c1-15(18,11-5-3-4-6-14(11)19-2)12-9-10(16)7-8-13(12)17/h3-9,18H,1-2H3
InChIKeySMYMNMHNFCRFJA-UHFFFAOYSA-N
XLogP3.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.18
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-2-fluorophenyl)-1-(2-methylphenyl)ethanol
CID 79743593
1-(5-fluoro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 82770802
1-(5-chloro-2-methoxyphenyl)-1-(2-fluorophenyl)ethanol
CID 62788121
1-(4-bromo-2-chlorophenyl)-1-(2-fluoro-3-methoxyphenyl)ethanol
CID 82808045
1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 116809641
1-(4-fluorophenyl)-1-(2-methoxyphenyl)ethanol
CID 60793238
1-(5-fluoro-2-methoxyphenyl)-1-(2-methylphenyl)ethanol
CID 82770234
1-(3-bromophenyl)-1-(2-fluoro-3-methoxyphenyl)ethanol
CID 82805505
1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
CID 106880255
4-bromo-2-(2-fluoropropan-2-yl)-1-methoxybenzene
CID 84706055
4-bromo-2-fluoro-1-(2-methoxyphenyl)benzene
CID 67003117
1-(5-bromo-2-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 83125325

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol (CID 79743336) is 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol is COc1ccccc1C(C)(O)c1cc(Br)ccc1F.
What is the InChIKey of 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol?
The InChIKey is SMYMNMHNFCRFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrFO2/c1-15(18,11-5-3-4-6-14(11)19-2)12-9-10(16)7-8-13(12)17/h3-9,18H,1-2H3.
What are the key properties of 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol?
1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol has a molecular weight of 325.18 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-fluorophenyl)-1-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 79743336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).