1-(2-Carboxy-2-Hydroxyethyl)-4-Hydroxy-2,5-Cyclohexadiene-1-Carboxylic Acid

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Properties Simple | Detailed

Formula C10H12O6
IUPAC Name 1-[(2r)-2-carboxy-2-hydroxy-ethyl]-4-hydroxy-cyclohexa-2,5-diene-1-carboxylic acid
Molecular Mass 228.199 g·mol−1
Heat of Formation -1027.7 ± 16.7 kJ·mol−1
Dipole Moment 2.09 ± 1.08 D
Volume 255.14 Å 3
Surface Area 230.63 Å 2
HOMO Energy -10.24 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
InChIKey NJHQXJPGTQOYFN-XSSZXYGBSA-N
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Elements H C O