Molecule ID: 62349

IUPAC Name: 4-methyl-7-propan-2-yloxepan-2-one

Description: The molecule is an epsilon-lactone that is oxepan-2-one which is substituted at positions 4 and 7 by methyl and isopropyl groups, respectively.

SMILES: CC1CCC(C(C)C)OC(=O)C1

SELFIES: [C][C][C][C][C][Branch1][=Branch1][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][Ring1][O]

InChI: InChI=1S/C10H18O2/c1-7(2)9-5-4-8(3)6-10(11)12-9/h7-9H,4-6H2,1-3H3

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 2.7