Diacetyl Hydrogen Phosphate

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Properties Simple | Detailed

Formula C4H7O6P
IUPAC Name [acetoxy(hydroxy)phosphoryl] acetate
Molecular Mass 182.069 g·mol−1
Heat of Formation -1508.9 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 175.1 Å 3
Surface Area 178.25 Å 2
HOMO Energy -10.59 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
Synonyms
  • (acetoxy-hydroxy-phosphoryl) acetate
  • (acetyloxy-hydroxy-phosphoryl) ethanoate
  • (acetyloxy-hydroxyphosphoryl) acetate
  • acetic acid (acetoxy-hydroxy-phosphoryl) ester
  • acetic acid (acetoxy-hydroxyphosphoryl) ester
  • acetic acid, dianhydride with phosphoric acid
  • diacetyl phosphate
CAS Number(s)
  • 3614-36-6
InChIKey XLLNINGEDIOQGQ-UHFFFAOYSA-N
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