Molecule ID: 18976074

IUPAC Name: 3-(1H-imidazol-5-yl)propanoate

Description: The molecule is an imidazolyl carboxylic acid anion that is the conjugate base of dihydrourocanic acid, obtained by deprotonation of the carboxy group. It derives from a propionate. It is a conjugate base of a dihydrourocanic acid.

SMILES: O=C([O-])CCc1cnc[nH]1

SELFIES: [O][=C][Branch1][C][O-1][C][C][C][=C][N][=C][NH1][Ring1][Branch1]

InChI: InChI=1S/C6H8N2O2/c9-6(10)2-1-5-3-7-4-8-5/h3-4H,1-2H2,(H,7,8)(H,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 68.8 Ų
- LogP: 0.4