Molecule ID: 192726

IUPAC Name: 3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid

Description: The molecule is a derivative of pyruvic acid carrying a 3,5-diiodo-4-hydroxyphenyl group at the 3-position. It derives from a pyruvic acid. It is a conjugate acid of a (3,5-diiodo-4-oxidophenyl)pyruvate(2-).

SMILES: O=C(O)C(=O)Cc1cc(I)c(O)c(I)c1

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

InChI: InChI=1S/C9H6I2O4/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,13H,3H2,(H,14,15)

Molecular Properties:
- Polar Surface Area: 74.6 Ų
- LogP: 2.2