3-C-Carboxy-2,4-Dideoxy-2-Methyl-D-Threo-Pentaric Acid

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Properties Simple | Detailed

Formula C7H10O7
IUPAC Name (2r,3s)-2-hydroxybutane-1,2,3-tricarboxylic acid
Molecular Mass 206.150 g·mol−1
Heat of Formation -1380.0 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 219.53 Å 3
Surface Area 202.15 Å 2
HOMO Energy -10.87 ± 0.55 eV
LUMO Energy 0.22 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-2-hydroxybutane-1,2,3-tricarboxylic acid
  • (2r,3s)-2-methylcitric acid
InChIKey YNOXCRMFGMSKIJ-WVBDSBKLSA-N
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Elements H C O