Molecule ID: 13074022

IUPAC Name: (4S)-2-[(Z)-but-2-enyl]-4-hydroxy-3-methylcyclopent-2-en-1-one

Description: The molecule is a beta-hydroxy ketone that is cyclopent-2-en-1-one which is substituted at positions 2, 3, and 4 by (2Z)-but-2-en-1-yl, methyl, and hydroxy groups, respectively (the 2S enantiomer). It is an alicyclic ketone, a beta-hydroxy ketone, an enone, a secondary allylic alcohol and a monoterpenoid.

SMILES: C/C=C\CC1=C(C)[C@@H](O)CC1=O

SELFIES: [C][/C][=C][\C][C][=C][Branch1][C][C][C@@H1][Branch1][C][O][C][C][Ring1][#Branch1][=O]

InChI: InChI=1S/C10H14O2/c1-3-4-5-8-7(2)9(11)6-10(8)12/h3-4,9,11H,5-6H2,1-2H3/b4-3-/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 0.7