ChemSpider 2D Image | 5'-O-[(R)-Hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]guanosine | C18H23N6O16P3

5'-O-[(R)-Hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]guanosine

  • Molecular FormulaC18H23N6O16P3
  • Average mass672.327 Da
  • Monoisotopic mass672.038330 Da
  • ChemSpider ID393377
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

5'-O-[(R)-Hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]guanosin [German] [ACD/IUPAC Name]
5'-O-[(R)-Hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]guanosine [ACD/IUPAC Name]
5'-O-[(R)-Hydroxy{[(R)-hydroxy({(S)-hydroxy[(1S)-1-(2-nitrophényl)éthoxy]phosphoryl}oxy)phosphoryl]oxy}phosphoryl]guanosine [French] [ACD/IUPAC Name]
Guanosine, 5'-O-[(R)-hydroxy[[(R)-hydroxy[[(S)-hydroxy[(1S)-1-(2-nitrophenyl)ethoxy]phosphinyl]oxy]phosphinyl]oxy]phosphinyl]- [ACD/Index Name]
CAG

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.2±0.1 g/cm3
Boiling Point: 1037.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 158.9±3.0 kJ/mol
Flash Point: 581.0±37.1 °C
Index of Refraction: 1.813
Molar Refractivity: 131.0±0.5 cm3
#H bond acceptors: 22
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -1.95
ACD/LogD (pH 5.5): -8.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 359 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 134.9±7.0 dyne/cm
Molar Volume: 302.9±7.0 cm3

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