1-(2,3-dihydrofuran-3-yl)ethanone

C6H8O2 — CID 70305160

IUPAC1-(2,3-dihydrofuran-3-yl)ethanone
SMILESCC(=O)C1C=COC1
InChIInChI=1S/C6H8O2/c1-5(7)6-2-3-8-4-6/h2-3,6H,4H2,1H3
InChIKeyIVWQXGJNLQYRCN-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.74
Rot. Bonds1

About 1-(2,3-dihydrofuran-3-yl)ethanone

1-(2,3-dihydrofuran-3-yl)ethanone (PubChem CID 70305160) has the molecular formula C6H8O2 and a molecular weight of 112.13 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-3-yl)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-3-yl)ethanone
PubChem CID70305160
Molecular FormulaC6H8O2
Molecular Weight112.13 g/mol
Exact Mass112.05
IUPAC Name1-(2,3-dihydrofuran-3-yl)ethanone
SMILESCC(=O)C1C=COC1
InChIInChI=1S/C6H8O2/c1-5(7)6-2-3-8-4-6/h2-3,6H,4H2,1H3
InChIKeyIVWQXGJNLQYRCN-UHFFFAOYSA-N
XLogP0.74
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-3-yl)ethanone?
The IUPAC name of 1-(2,3-dihydrofuran-3-yl)ethanone (CID 70305160) is 1-(2,3-dihydrofuran-3-yl)ethanone.
What is the SMILES notation for 1-(2,3-dihydrofuran-3-yl)ethanone?
The canonical SMILES for 1-(2,3-dihydrofuran-3-yl)ethanone is CC(=O)C1C=COC1.
What is the InChIKey of 1-(2,3-dihydrofuran-3-yl)ethanone?
The InChIKey is IVWQXGJNLQYRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2/c1-5(7)6-2-3-8-4-6/h2-3,6H,4H2,1H3.
What are the key properties of 1-(2,3-dihydrofuran-3-yl)ethanone?
1-(2,3-dihydrofuran-3-yl)ethanone has a molecular weight of 112.13 g/mol, XLogP of 0.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-3-yl)ethanone is sourced from PubChem (CID 70305160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).