Molecule ID: 91825612

IUPAC Name: 4-hydroxy-6-(2-hydroxytridecyl)pyran-2-one

Description: The molecule is a 6-alkyl-4-hydroxy-2H-pyran-2-one that is 4-hydroxy-2H-pyran-2-one in which the hydrogen at position 6 is replaced by a 2-hydroxytridecyl group. It is a 6-alkyl-4-hydroxy-2H-pyran-2-one and a secondary alcohol.

SMILES: CCCCCCCCCCCC(O)Cc1cc(O)cc(=O)o1

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

InChI: InChI=1S/C18H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(19)12-17-13-16(20)14-18(21)22-17/h13-15,19-20H,2-12H2,1H3

Molecular Properties:
- Polar Surface Area: 66.8 Ų
- LogP: 5.4