Molecule ID: 3434975

IUPAC Name: 2-acetyloxybenzoate

Description: The molecule is a benzoate that is the conjugate base of acetylsalicylic acid, arising from deprotonation of the carboxy group. It derives from a salicylate. It is a conjugate base of an acetylsalicylic acid.

SMILES: CC(=O)Oc1ccccc1C(=O)[O-]

SELFIES: [C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/p-1

Molecular Properties:
- Polar Surface Area: 66.4 Ų
- LogP: 1.8