Molecule ID: 545250

IUPAC Name: decan-2-yl propanoate

Description: The molecule is a propanoate ester obtained by the formal condensation of propionic acid with decan-2-ol. It has a role as a metabolite.

SMILES: CCCCCCCCC(C)OC(=O)CC

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

InChI: InChI=1S/C13H26O2/c1-4-6-7-8-9-10-11-12(3)15-13(14)5-2/h12H,4-11H2,1-3H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 5.0