Molecule ID: 7803

IUPAC Name: propyl propanoate

Description: The molecule is a propanoate ester resulting from the formal condensation of the hydroxy group of propanol with the carboxy group of propanoic acid. It has a role as a human metabolite, a rat metabolite, a biomarker and a fungal metabolite. It derives from a propan-1-ol.

SMILES: CCCOC(=O)CC

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

InChI: InChI=1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 1.7