(2Z)-3-Cyano-3-(Phosphonooxy)Acrylic Acid

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Properties Simple | Detailed

Formula C4H4NO6P
IUPAC Name (z)-3-cyano-3-phosphonooxy-prop-2-enoic acid
Molecular Mass 193.051 g·mol−1
Heat of Formation -1217.3 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 186.53 Å 3
Surface Area 184.7 Å 2
HOMO Energy -10.39 ± 0.55 eV
LUMO Energy -1.77 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-3-cyano-3-phosphonooxy-acrylic acid
  • (z)-3-cyano-3-phosphonooxy-prop-2-enoic acid
  • (z)-3-cyano-3-phosphonooxyprop-2-enoic acid
  • 3-cyanophosphoenolpyruvate
CAS Number(s)
  • 99128-95-7
InChIKey QMNPVZVOSAIBKM-IWQZZHSRSA-N
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