Molecule ID: 78429

IUPAC Name: 3,4-dihydroisochromen-1-one

Description: The molecule is the simplest member of the class of dihydroisocoumarins that is the 3,4-dihydro derivative of isocoumarin. It derives from an isocoumarin.

SMILES: O=C1OCCc2ccccc21

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

InChI: InChI=1S/C9H8O2/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-4H,5-6H2

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 1.8