Molecule ID: 91695386

IUPAC Name: 2-methylbutyl 2-acetyloxyacetate

Description: The molecule is an acetate ester obtained by the formal condensation of the carboy group of (acetyloxy)acetic acid with 2-methylbutanol. It has a role as a metabolite.

SMILES: CCC(C)COC(=O)COC(C)=O

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

InChI: InChI=1S/C9H16O4/c1-4-7(2)5-13-9(11)6-12-8(3)10/h7H,4-6H2,1-3H3

Molecular Properties:
- Polar Surface Area: 52.6 Ų
- LogP: 1.7