ChemSpider 2D Image | 7-[beta-D-(C~2~-~2~H)Ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine | C11H13DN4O4

7-[β-D-(C2-2H)Ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

  • Molecular FormulaC11H13DN4O4
  • Average mass267.259 Da
  • Monoisotopic mass267.107788 Da
  • ChemSpider ID9218903

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

7-[β-D-(C2-2H)Ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
7-[β-D-(C2-2H)Ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine [ACD/IUPAC Name]
7-[β-D-(C2-2H)Ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-(β-D-ribofuranosyl-C2-d)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 648.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 346.2±31.5 °C
Index of Refraction: 1.834
Molar Refractivity: 61.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.12
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.95
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.72
Polar Surface Area: 127 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 91.6±7.0 dyne/cm
Molar Volume: 139.5±7.0 cm3

Click to predict properties on the Chemicalize site


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