Cas no 793655-42-2 (Triphosphoric acid, P-[[(2R,3R,3aS,9aR)-2,3,3a,9a-tetrahydro-3-hydroxy-6-oxo-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl] ester)

Triphosphoric acid, P-[[(2R,3R,3aS,9aR)-2,3,3a,9a-tetrahydro-3-hydroxy-6-oxo-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl] ester structure
793655-42-2 structure
Product Name:Triphosphoric acid, P-[[(2R,3R,3aS,9aR)-2,3,3a,9a-tetrahydro-3-hydroxy-6-oxo-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl] ester
CAS No:793655-42-2
MF:C9H13N2O14P3
MW:466.125805616379
CID:6951337
Update Time:2025-07-24

Triphosphoric acid, P-[[(2R,3R,3aS,9aR)-2,3,3a,9a-tetrahydro-3-hydroxy-6-oxo-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl] ester Chemical and Physical Properties

Names and Identifiers

    • Triphosphoric acid, P-[[(2R,3R,3aS,9aR)-2,3,3a,9a-tetrahydro-3-hydroxy-6-oxo-6H-furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-2-yl]methyl] ester
    • Inchi: 1S/C9H13N2O14P3/c12-5-1-2-11-8-7(23-9(11)10-5)6(13)4(22-8)3-21-27(17,18)25-28(19,20)24-26(14,15)16/h1-2,4,6-8,13H,3H2,(H,17,18)(H,19,20)(H2,14,15,16)/t4-,6-,7+,8-/m1/s1
    • InChI Key: BCVDHAYEJIHXLG-CCXZUQQUSA-N
    • SMILES: O[C@@H]1[C@H](O[C@@]2([H])N3C=CC(N=C3O[C@]21[H])=O)COP(O)(=O)OP(O)(=O)OP(O)(O)=O

Experimental Properties

  • Density: 2.638±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
  • Boiling Point: 783.104±70.00 °C(Press: 760.00 Torr)(predicted)
  • pka: 0.788±0.50(predicted)
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