1-(1-benzofuran-2-yl)ethanone

C10H8O2 — CID 15435

IUPAC1-(1-benzofuran-2-yl)ethanone
SMILESCC(=O)c1cc2ccccc2o1
InChIInChI=1S/C10H8O2/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-6H,1H3
InChIKeyYUTFQTAITWWGFH-UHFFFAOYSA-N
MW160.17 g/mol
LogP2.64
Rot. Bonds1

About 1-(1-benzofuran-2-yl)ethanone

1-(1-benzofuran-2-yl)ethanone (PubChem CID 15435) has the molecular formula C10H8O2 and a molecular weight of 160.17 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)ethanone.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)ethanone
PubChem CID15435
Molecular FormulaC10H8O2
Molecular Weight160.17 g/mol
Exact Mass160.05
IUPAC Name1-(1-benzofuran-2-yl)ethanone
SMILESCC(=O)c1cc2ccccc2o1
InChIInChI=1S/C10H8O2/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-6H,1H3
InChIKeyYUTFQTAITWWGFH-UHFFFAOYSA-N
XLogP2.64
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-benzofuran-2-yl)ethanone;molecular hydrogen;toluene;dihydrate
CID 142129811
1-(1-benzofuran-2-yl)-2,2-dimethylpropan-1-one
CID 13148492
1-[4-(1-benzofuran-2-carbonyl)thiophen-2-yl]ethanone
CID 3747512
1-benzofuran-2-carboxamide;hydrate;dihydrochloride
CID 144595737
1-(5-amino-1-benzofuran-2-yl)ethanone
CID 3783367
1-(6-methyl-1-benzofuran-2-yl)ethanone
CID 159473013
1-(5-methyl-1-benzofuran-2-yl)ethanone
CID 15549614
CID 171632715
CID 171632715
[(E)-1-(1-benzofuran-2-yl)ethylideneamino] acetate
CID 53467236
[1-benzofuran-2-yl(methoxy)methylidene]chromium
CID 134878936
3-amino-1-(1-benzofuran-2-yl)propan-1-one
CID 82275110
tert-butyl 1-benzofuran-2-carboxylate
CID 63896278

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)ethanone?
The IUPAC name of 1-(1-benzofuran-2-yl)ethanone (CID 15435) is 1-(1-benzofuran-2-yl)ethanone.
What is the SMILES notation for 1-(1-benzofuran-2-yl)ethanone?
The canonical SMILES for 1-(1-benzofuran-2-yl)ethanone is CC(=O)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)ethanone?
The InChIKey is YUTFQTAITWWGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-6H,1H3.
What are the key properties of 1-(1-benzofuran-2-yl)ethanone?
1-(1-benzofuran-2-yl)ethanone has a molecular weight of 160.17 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)ethanone is sourced from PubChem (CID 15435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).