Structure Database (LMSD)

Common Name
3-Acetyldihydro-2(3H)-furanone
Systematic Name
3-Acetyldihydro-2(3H)-furanone
Synonyms
LM ID
LMFA07040005
Status
Active
Exact Mass
Calculate m/z
128.047345
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
OMQHDIHZSDEIFH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C6H8O3/c1-4(7)5-2-3-9-6(5)8/h5H,2-3H2,1H3
SMILES (Click to copy)
C1COC(=O)C1C(=O)C

References

Comments
Pherobase Semiochemicals

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 9
Rings 1
Aromatic Rings 0
Rotatable Bonds 1
Van der Waals Molecular Volume 121.09
Topological Polar Surface Area 45.44
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
logP 0.42
Molar Refractivity 30.24

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Updated at
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