ChemSpider 2D Image | 5'-O-{Hydroxy[(4-hydroxy-2,4-dioxido-1,3,5,2,4-trioxadiphosphinan-2-yl)oxy]phosphoryl}guanosine | C11H16N5O14P3


  • Molecular FormulaC11H16N5O14P3
  • Average mass535.191 Da
  • Monoisotopic mass534.990662 Da
  • ChemSpider ID147915
  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

5'-O-{Hydroxy[(4-hydroxy-2,4-dioxido-1,3,5,2,4-trioxadiphosphinan-2-yl)oxy]phosphoryl}guanosin [German] [ACD/IUPAC Name]
5'-O-{Hydroxy[(4-hydroxy-2,4-dioxido-1,3,5,2,4-trioxadiphosphinan-2-yl)oxy]phosphoryl}guanosine [ACD/IUPAC Name]
5'-O-{Hydroxy[(4-hydroxy-2,4-dioxydo-1,3,5,2,4-trioxadiphosphinan-2-yl)oxy]phosphoryl}guanosine [French] [ACD/IUPAC Name]
Guanosine, 5'-O-[hydroxy[(4-hydroxy-2,4-dioxido-1,3,5,2,4-trioxadiphosphorinan-2-yl)oxy]phosphinyl]- [ACD/Index Name]
30100-88-0 [RN]
Guanosine 5'-(tetrahydrogen triphosphate), cyclic P',P''-methylene ester
Guanosine 5'-(β,γ-methylene)triphosphate
β,γ-Methylene-guanosine 5'-triphosphate

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

Density: 2.7±0.1 g/cm3
Boiling Point: 902.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 137.5±3.0 kJ/mol
Flash Point: 499.8±37.1 °C
Index of Refraction: 1.940
Molar Refractivity: 93.8±0.5 cm3
#H bond acceptors: 19
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 302 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 202.3±7.0 dyne/cm
Molar Volume: 195.6±7.0 cm3

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