ChemSpider 2D Image | Diphosphoric acid, mono[(2-amino-3,4,7,8-tetrahydro-4-oxo-6-pteridinyl)methyl] ester, ion(3-) | C7H8N5O8P2

Diphosphoric acid, mono[(2-amino-3,4,7,8-tetrahydro-4-oxo-6-pteridinyl)methyl] ester, ion(3-)

  • Molecular FormulaC7H8N5O8P2
  • Average mass352.116 Da
  • Monoisotopic mass351.986450 Da
  • ChemSpider ID24784870

  • Charge - Charge

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Diphosphoric acid, mono[(2-amino-3,4,7,8-tetrahydro-4-oxo-6-pteridinyl)methyl] ester, ion(3-) [ACD/Index Name]
(2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate
(2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate trianion
(2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate(3-)
(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl diphosphate
(7,8-dihydropterin-6-yl)methyl diphosphate
(7,8-dihydropterin-6-yl)methyl diphosphate(3-)
2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine diphosphate
2-amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)-pteridine
6-hydroxymethyl-7,8-dihydropterin diphosphate
More...
  • Miscellaneous

    • Chemical Class:

      An organophosphate oxoanion obtained by deprotonation of the diphosphate OH groups of (7,8-dihydropterin-6-yl)methyl diphosphate. ChEBI CHEBI:72950
      Trianion of (2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate arising from deprotonation of the three diphosphate OH groups. ChEBI CHEBI:57602

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -5.72
ACD/LogD (pH 5.5): -8.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 233 Å2
Polarizability:
Surface Tension:
Molar Volume:

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