ChemSpider 2D Image | 4-Amino-1-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-3-(hydroxymethyl)-2(1H)-pyridinone | C11H17N2O8P

4-Amino-1-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-3-(hydroxymethyl)-2(1H)-pyridinone

  • Molecular FormulaC11H17N2O8P
  • Average mass336.235 Da
  • Monoisotopic mass336.072000 Da
  • ChemSpider ID25057988
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

2(1H)-Pyridinone, 4-amino-1-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-3-(hydroxymethyl)- [ACD/Index Name]
4-Amino-1-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-3-(hydroxymethyl)-2(1H)-pyridinone [ACD/IUPAC Name]
4-Amino-1-(2-desoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-3-(hydroxymethyl)-2(1H)-pyridinon [German] [ACD/IUPAC Name]
4-Amino-1-(2-désoxy-5-O-phosphono-β-D-érythro-pentofuranosyl)-3-(hydroxyméthyl)-2(1H)-pyridinone [French] [ACD/IUPAC Name]

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

Density: 1.7±0.0 g/cm3
Boiling Point: 708.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 118.4±0.0 kJ/mol
Flash Point: 382.0±0.0 °C
Index of Refraction: 1.638
Molar Refractivity: 71.8±0.0 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 173 Å2
Polarizability: 28.5±0.0 10-24cm3
Surface Tension: 89.7±0.0 dyne/cm
Molar Volume: 199.7±0.0 cm3

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