Molecule ID: 104

IUPAC Name: 2-(2-oxo-3H-furan-5-yl)acetic acid

Description: The molecule is the 4,5-dihydro- derivative of 5-oxo-2-furylacetic acid. It has a role as a bacterial metabolite. It is a conjugate acid of a 5-oxo-4,5-dihydro-2-furylacetate.

SMILES: O=C(O)CC1=CCC(=O)O1

SELFIES: [O][=C][Branch1][C][O][C][C][=C][C][C][=Branch1][C][=O][O][Ring1][=Branch1]

InChI: InChI=1S/C6H6O4/c7-5(8)3-4-1-2-6(9)10-4/h1H,2-3H2,(H,7,8)

Molecular Properties:
- Polar Surface Area: 63.6 Ų
- LogP: -0.3