ChemSpider 2D Image | 3',5'-Bis-O-[(phosphonatooxy)phosphinato]adenosine | C10H11N5O16P4

3',5'-Bis-O-[(phosphonatooxy)phosphinato]adenosine

  • Molecular FormulaC10H11N5O16P4
  • Average mass581.117 Da
  • Monoisotopic mass580.918396 Da
  • ChemSpider ID23350664

  • Charge - Charge

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3',5'-Bis-O-[(phosphonatooxy)phosphinato]adenosine
adenosine, 3',5'-bis(trihydrogen diphosphate), ion(6-)
28218-64-6 [RN]
adenosine 3'-diphosphate 5'-diphosphate

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

Density:
Boiling Point: 1060.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 162.7±3.0 kJ/mol
Flash Point: 595.2±37.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 21
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -5.89
ACD/LogD (pH 5.5): -13.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -14.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 382 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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