Molecule ID: 54678950

IUPAC Name: 6-heptyl-4-hydroxypyran-2-one

Description: The molecule is a 2-pyranone in which the hydrogens at positions 4 and 6 of 2H-pyran-2-one are replaced by hydroxy and heptyl groups respectively. It is a member of 2-pyranones and a heteroaryl hydroxy compound.

SMILES: CCCCCCCc1cc(O)cc(=O)o1

SELFIES: [C][C][C][C][C][C][C][C][=C][C][Branch1][C][O][=C][C][=Branch1][C][=O][O][Ring1][Branch2]

InChI: InChI=1S/C12H18O3/c1-2-3-4-5-6-7-11-8-10(13)9-12(14)15-11/h8-9,13H,2-7H2,1H3

Molecular Properties:
- Polar Surface Area: 46.5 Ų
- LogP: 3.5