Molecule ID: 134716628

IUPAC Name: 2,3-dihydroxydodecanoate

Description: The molecule is a medium-chain fatty acid anion resulting from the deprotonation of the carboxy group of 2,3-dihydroxydodecanoic acid. Major microspecies at pH 7.3 It is a 2-hydroxy fatty acid anion, a 3-hydroxy fatty acid anion and a medium-chain fatty acid anion. It derives from a dodecanoate. It is a conjugate base of a 2,3-dihydroxydodecanoic acid.

SMILES: CCCCCCCCCC(O)C(O)C(=O)[O-]

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

InChI: InChI=1S/C12H24O4/c1-2-3-4-5-6-7-8-9-10(13)11(14)12(15)16/h10-11,13-14H,2-9H2,1H3,(H,15,16)/p-1

Molecular Properties:
- Polar Surface Area: 80.6 Ų
- LogP: 3.7