Molecule ID: 69410

IUPAC Name: 4-acetyloxybutyl acetate

Description: The molecule is an acetate ester obtained by the formal condensation of the two hydroxy groups of butane-1,4-diol with two molecules of acetic acid It has a role as a metabolite. It derives from a butane-1,4-diol.

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

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

InChI: InChI=1S/C8H14O4/c1-7(9)11-5-3-4-6-12-8(2)10/h3-6H2,1-2H3

Molecular Properties:
- Polar Surface Area: 52.6 Ų
- LogP: 0.7