Molecule ID: 519786

IUPAC Name: 3-methylbutyl 2-methylpropanoate

Description: The molecule is a fatty acid ester obtained by the formal condensation of isoamylol with isobutyric acid. It has a role as a metabolite. It derives from an isoamylol and an isobutyric acid.

SMILES: CC(C)CCOC(=O)C(C)C

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

InChI: InChI=1S/C9H18O2/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 2.8