3-(Hydroxymethyl)-3-Buten-1-Yl Trihydrogen Diphosphate

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Properties Simple | Detailed

Formula C5H12O8P2
IUPAC Name 3-(hydroxymethyl)but-3-enyl phosphono hydrogen phosphate
Molecular Mass 262.092 g·mol−1
Heat of Formation -2051.6 ± 16.7 kJ·mol−1
Dipole Moment 2.47 ± 1.08 D
Volume 267.28 Å 3
Surface Area 250.88 Å 2
HOMO Energy -9.81 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methylolbut-3-enyl phosphono hydrogen phosphate
InChIKey DFMXRQRICFHJAS-UHFFFAOYSA-N
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Elements P C O H