Basic information
- CAS
22971-60-4- Standard SMILES
O=C(O)CCCC(=O)c1ccco1- InChIKey
AYVOKQOMZXAYTL-UHFFFAOYSA-N- Molecular formula
- C9H10O4
- Average molar mass
- 182.17 g/mol
- Monoisotopic mass
- 182.0579088
Names & identifiers
- Preferred name
- 5-(Furan-2-yl)-5-oxopentanoic acid
- IUPAC
- 5-(furan-2-yl)-5-oxopentanoic acid
Names & synonyms
5-(furan-2-yl)-5-oxopentanoic acid22971-60-4NSC80410SCHEMBL9696259DTXSID402921295-(2-furyl)-5-oxo-pentanoic acidNSC-80410DS-005572
Database identifiers
- CAS
22971-60-4- PubChem CID
- 255154
- DTXSID
DTXSID40292129
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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