Molecule ID: 440310

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

Description: The molecule is a 2-hydroxy monocarboxylic acid that is lactic acid substituted by a 4-hydroxy-3,5-diiodophenyl group at position 3. It is an organoiodine compound, a member of phenols and a 2-hydroxy monocarboxylic acid. It derives from a 2-hydroxypropanoic acid. It is a conjugate acid of a 3-(4-hydroxy-3,5-diiodophenyl)lactate.

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/C9H8I2O4/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,12-13H,3H2,(H,14,15)

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 2.1