(2S)-2,3,3-Trihydroxy-6-Methyl-4-Oxoheptyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C8H17O8P
IUPAC Name [(2s)-2,3,3-trihydroxy-6-methyl-4-oxo-heptyl] dihydrogen phosphate
Molecular Mass 272.190 g·mol−1
Heat of Formation -1875.3 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 296.68 Å 3
Surface Area 274.51 Å 2
HOMO Energy -9.99 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
InChIKey JMUSONIELWHGQU-ZETCQYMHSA-N
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