Molecule ID: 65123

IUPAC Name: benzo[b][1,4]benzodioxepin-6-one

Description: The molecule is the simplest member of the class of depsidones comprising of a heterotricyclic system that is 11H-dibenzo[b,e][1,4]dioxepine substituted by an oxo group at position 11. It is a member of depsidones and an organic heterotricyclic compound.

SMILES: O=C1Oc2ccccc2Oc2ccccc21

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

InChI: InChI=1S/C13H8O3/c14-13-9-5-1-2-6-10(9)15-11-7-3-4-8-12(11)16-13/h1-8H

Molecular Properties:
- Polar Surface Area: 35.5 Ų
- LogP: 2.9