I+/--Oxo-2-furanbutanal
Basic information
- CAS
150270-12-5- Standard SMILES
O=CC(=O)CCc1ccco1- InChIKey
GEAYXSRBDYFSGW-UHFFFAOYSA-N- Molecular formula
- C8H8O3
- Average molar mass
- 152.15 g/mol
- Monoisotopic mass
- 152.04734411
Names & identifiers
- Preferred name
- I+/--Oxo-2-furanbutanal
- IUPAC
- 4-(furan-2-yl)-2-oxobutanal
Names & synonyms
I+/--Oxo-2-furanbutanal4-(Furan-2-yl)-2-oxobutanalDTXSID101315077150270-12-5
Database identifiers
- CAS
150270-12-5- PubChem CID
- 165359377
- DTXSID
DTXSID101315077
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
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Related reactions
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Compound notes
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