ChemSpider 2D Image | 9-[3-Deoxy-3-(hydroxymethyl)hexofuranosyl]-9H-purin-6-amine | C12H17N5O5

9-[3-Deoxy-3-(hydroxymethyl)hexofuranosyl]-9H-purin-6-amine

  • Molecular FormulaC12H17N5O5
  • Average mass311.294 Da
  • Monoisotopic mass311.122955 Da
  • ChemSpider ID21211301

More details:

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

9-[3-Deoxy-3-(hydroxymethyl)hexofuranosyl]-9H-purin-6-amine [ACD/IUPAC Name]
9-[3-Desoxy-3-(hydroxymethyl)hexofuranosyl]-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-[3-Désoxy-3-(hydroxyméthyl)hexofuranosyl]-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[3-deoxy-3-(hydroxymethyl)hexofuranosyl]- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 750.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.8±3.0 kJ/mol
Flash Point: 407.6±35.7 °C
Index of Refraction: 1.844
Molar Refractivity: 70.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.33
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.66
ACD/LogD (pH 7.4): -1.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.80
Polar Surface Area: 160 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 97.8±7.0 dyne/cm
Molar Volume: 157.6±7.0 cm3

Click to predict properties on the Chemicalize site


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