ChemSpider 2D Image | [4-(6-Amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl trihydrogen diphosphate | C11H17N5O9P2

[4-(6-Amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl trihydrogen diphosphate

  • Molecular FormulaC11H17N5O9P2
  • Average mass425.228 Da
  • Monoisotopic mass425.050140 Da
  • ChemSpider ID28565284

More details:

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

[4-(6-Amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl trihydrogen diphosphate [ACD/IUPAC Name]
[4-(6-Amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyltrihydrogendiphosphat [German] [ACD/IUPAC Name]
Diphosphoric acid, mono[[4-(6-amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl] ester [ACD/Index Name]
Trihydrogénodiphosphate de [4-(6-amino-9H-purin-9-yl)-2,3-dihydroxycyclopentyl]méthyle [French] [ACD/IUPAC Name]
5421-23-8 [RN]

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

Density: 2.4±0.1 g/cm3
Boiling Point: 805.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.8±3.0 kJ/mol
Flash Point: 441.1±37.1 °C
Index of Refraction: 1.885
Molar Refractivity: 83.1±0.5 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -3.77
ACD/LogD (pH 5.5): -8.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 243 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 155.4±7.0 dyne/cm
Molar Volume: 180.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement