1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone

C16H11FO3 — CID 103458090

IUPAC1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone
SMILESO=C(c1cc2cccc(F)c2o1)C(O)c1ccccc1
InChIInChI=1S/C16H11FO3/c17-12-8-4-7-11-9-13(20-16(11)12)15(19)14(18)10-5-2-1-3-6-10/h1-9,14,18H
InChIKeySZQDAVHCFBOMMO-UHFFFAOYSA-N
MW270.26 g/mol
LogP3.49
Rot. Bonds3

About 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone

1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone (PubChem CID 103458090) has the molecular formula C16H11FO3 and a molecular weight of 270.26 g/mol. Its IUPAC name is 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone.

Molecular Properties

Compound Name1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone
PubChem CID103458090
Molecular FormulaC16H11FO3
Molecular Weight270.26 g/mol
Exact Mass270.07
IUPAC Name1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone
SMILESO=C(c1cc2cccc(F)c2o1)C(O)c1ccccc1
InChIInChI=1S/C16H11FO3/c17-12-8-4-7-11-9-13(20-16(11)12)15(19)14(18)10-5-2-1-3-6-10/h1-9,14,18H
InChIKeySZQDAVHCFBOMMO-UHFFFAOYSA-N
XLogP3.49
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-chloro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone
CID 103458183
7-fluoro-1-benzofuran-2-carboxylic acid
CID 22244304
2-amino-1-(7-fluoro-1-benzofuran-2-yl)butan-1-one
CID 114736846
1-(7-fluoro-1-benzofuran-2-yl)-2-methyl-2-phenylpropan-1-one
CID 114725241
(3,5-difluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanone
CID 115957454
(3,4-difluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanone
CID 115957426
(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanone
CID 114725192
1-(7-fluoro-1-benzofuran-2-yl)-2-(3-fluorophenyl)sulfanylethanone
CID 114725527
2-methyl-1-(7-phenyl-1-benzofuran-2-yl)propan-1-one
CID 65426129
(7-fluoro-1-benzofuran-2-yl)-(5-iodothiophen-3-yl)methanone
CID 115810047
4-chloro-1-(7-fluoro-1-benzofuran-2-yl)butan-1-one
CID 114725511
1-(7-fluoro-1-benzofuran-2-yl)-2-(prop-2-ynylamino)ethanone
CID 114736948

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone?
The IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone (CID 103458090) is 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone.
What is the SMILES notation for 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone?
The canonical SMILES for 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone is O=C(c1cc2cccc(F)c2o1)C(O)c1ccccc1.
What is the InChIKey of 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone?
The InChIKey is SZQDAVHCFBOMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FO3/c17-12-8-4-7-11-9-13(20-16(11)12)15(19)14(18)10-5-2-1-3-6-10/h1-9,14,18H.
What are the key properties of 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone?
1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone has a molecular weight of 270.26 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-1-benzofuran-2-yl)-2-hydroxy-2-phenylethanone is sourced from PubChem (CID 103458090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).