Molecule ID: 12126

IUPAC Name: 3-ethoxybenzoic acid

Description: The molecule is an ethoxybenzoic acid carrying an ethoxy substituent at position 3. It derives from a benzoic acid. It is a conjugate acid of a 3-ethoxybenzoate.

SMILES: CCOc1cccc(C(=O)O)c1

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

InChI: InChI=1S/C9H10O3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3,(H,10,11)

Molecular Properties:
- Polar Surface Area: 46.5 Ų
- LogP: 2.4