1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol

C16H12F2O2 — CID 114726361

IUPAC1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol
SMILESOC(Cc1ccccc1F)c1cc2cc(F)ccc2o1
InChIInChI=1S/C16H12F2O2/c17-12-5-6-15-11(7-12)9-16(20-15)14(19)8-10-3-1-2-4-13(10)18/h1-7,9,14,19H,8H2
InChIKeyLSDYICVCTGHNME-UHFFFAOYSA-N
MW274.27 g/mol
LogP3.99
Rot. Bonds3

About 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol

1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol (PubChem CID 114726361) has the molecular formula C16H12F2O2 and a molecular weight of 274.27 g/mol. Its IUPAC name is 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol
PubChem CID114726361
Molecular FormulaC16H12F2O2
Molecular Weight274.27 g/mol
Exact Mass274.08
IUPAC Name1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol
SMILESOC(Cc1ccccc1F)c1cc2cc(F)ccc2o1
InChIInChI=1S/C16H12F2O2/c17-12-5-6-15-11(7-12)9-16(20-15)14(19)8-10-3-1-2-4-13(10)18/h1-7,9,14,19H,8H2
InChIKeyLSDYICVCTGHNME-UHFFFAOYSA-N
XLogP3.99
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-2-(2-fluorophenyl)ethanol
CID 61086986
1-(5-chloro-1-benzofuran-2-yl)-2-(2-methoxyphenyl)ethanol
CID 114726331
1-(1-benzofuran-2-yl)-2-(2-methylphenyl)ethanol
CID 63017903
2-(dimethylamino)-1-(5-fluoro-1-benzofuran-2-yl)ethanol
CID 114726918
1-(5-fluoro-1-benzofuran-2-yl)but-3-en-1-ol
CID 114727304
2-(2-chlorophenyl)-1-(5-fluoro-1-benzofuran-2-yl)ethanamine
CID 114728213
2-(5-chloro-2-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 103053486
(2,3-difluorophenyl)-(5-fluoro-1-benzofuran-2-yl)methanol
CID 114723648
3-(dimethylamino)-1-(5-fluoro-1-benzofuran-2-yl)propan-1-ol
CID 114727140
4-ethoxy-1-(5-fluoro-1-benzofuran-2-yl)butan-1-ol
CID 105129637
2-(3-fluorophenyl)-1-(5-methyl-1-benzofuran-2-yl)ethanol
CID 63016416
2-(5-fluoro-1-benzofuran-2-yl)-1-(2-fluorophenyl)propan-2-ol
CID 114832934

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol?
The IUPAC name of 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol (CID 114726361) is 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol.
What is the SMILES notation for 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol?
The canonical SMILES for 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol is OC(Cc1ccccc1F)c1cc2cc(F)ccc2o1.
What is the InChIKey of 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol?
The InChIKey is LSDYICVCTGHNME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2O2/c17-12-5-6-15-11(7-12)9-16(20-15)14(19)8-10-3-1-2-4-13(10)18/h1-7,9,14,19H,8H2.
What are the key properties of 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol?
1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol has a molecular weight of 274.27 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-1-benzofuran-2-yl)-2-(2-fluorophenyl)ethanol is sourced from PubChem (CID 114726361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).