ChemSpider 2D Image | 2-Amino-9-(D-xylofuranosyl)-1,9-dihydro-6H-purine-6-thione | C10H13N5O4S

2-Amino-9-(D-xylofuranosyl)-1,9-dihydro-6H-purine-6-thione

  • Molecular FormulaC10H13N5O4S
  • Average mass299.306 Da
  • Monoisotopic mass299.068817 Da
  • ChemSpider ID24674584

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2-Amino-9-(D-xylofuranosyl)-1,9-dihydro-6H-purin-6-thion [German] [ACD/IUPAC Name]
2-Amino-9-(D-xylofuranosyl)-1,9-dihydro-6H-purine-6-thione [ACD/IUPAC Name]
2-Amino-9-(D-xylofuranosyl)-1,9-dihydro-6H-purine-6-thione [French] [ACD/IUPAC Name]
9H-Purine-6-thiol, 2-amino-9-D-xylofuranosyl- [ACD/Index Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 758.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.0±3.0 kJ/mol
Flash Point: 412.6±35.7 °C
Index of Refraction: 1.975
Molar Refractivity: 67.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.15
ACD/LogD (pH 5.5): -3.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 178 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 108.4±7.0 dyne/cm
Molar Volume: 136.9±7.0 cm3

Click to predict properties on the Chemicalize site


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