ChemSpider 2D Image | 6-Isopropoxy-9-[(3xi)-beta-D-threo-pentofuranosyl]-9H-purin-2-amine | C13H19N5O5

6-Isopropoxy-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-2-amine

  • Molecular FormulaC13H19N5O5
  • Average mass325.320 Da
  • Monoisotopic mass325.138611 Da
  • ChemSpider ID59757929

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

6-Isopropoxy-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-2-amin [German] [ACD/IUPAC Name]
6-Isopropoxy-9-[(3ξ)-β-D-threo-pentofuranosyl]-9H-purin-2-amine [ACD/IUPAC Name]
6-Isopropoxy-9-[(3ξ)-β-D-thréo-pentofuranosyl]-9H-purin-2-amine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 6-(1-methylethoxy)-9-[(3ξ)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
82773-20-4 [RN]
O6-Isopropylguanosine

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

Density: 1.8±0.1 g/cm3
Boiling Point: 693.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 373.5±34.3 °C
Index of Refraction: 1.764
Molar Refractivity: 74.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.30
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.13
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.53
Polar Surface Area: 149 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 74.8±7.0 dyne/cm
Molar Volume: 181.2±7.0 cm3

Click to predict properties on the Chemicalize site


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