Molecule ID: 77553

IUPAC Name: 3-acetylchromen-2-one

Description: The molecule is a member of the class of coumarins that is coumarin in which the hydrogen at position 3 is replaced by an acetyl group.

SMILES: CC(=O)c1cc2ccccc2oc1=O

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

InChI: InChI=1S/C11H8O3/c1-7(12)9-6-8-4-2-3-5-10(8)14-11(9)13/h2-6H,1H3

Molecular Properties:
- Polar Surface Area: 43.4 Ų
- LogP: 1.8