ChemSpider 2D Image | (4S)-2-(6-Amino-9H-purin-9-yl)-4-(hydroxymethyl)tetrahydro-3,4-furandiol | C10H13N5O4

(4S)-2-(6-Amino-9H-purin-9-yl)-4-(hydroxymethyl)tetrahydro-3,4-furandiol

  • Molecular FormulaC10H13N5O4
  • Average mass267.241 Da
  • Monoisotopic mass267.096741 Da
  • ChemSpider ID24816337
  • defined stereocentres - 1 of 3 defined stereocentres


More details:






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

(4S)-2-(6-Amino-9H-purin-9-yl)-4-(hydroxymethyl)tetrahydro-3,4-furandiol [ACD/IUPAC Name]
(4S)-2-(6-Amino-9H-purin-9-yl)-4-(hydroxymethyl)tetrahydro-3,4-furandiol [German] [ACD/IUPAC Name]
(4S)-2-(6-Amino-9H-purin-9-yl)-4-(hydroxyméthyl)tétrahydro-3,4-furanediol [French] [ACD/IUPAC Name]
3,4-Furandiol, 2-(6-amino-9H-purin-9-yl)tetrahydro-4-(hydroxymethyl)-, (4S)- [ACD/Index Name]
ZINC03650515

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

Density: 2.0±0.1 g/cm3
Boiling Point: 666.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 357.0±34.3 °C
Index of Refraction: 1.867
Molar Refractivity: 60.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.00
ACD/LogD (pH 7.4): -0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.36
Polar Surface Area: 140 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 105.2±7.0 dyne/cm
Molar Volume: 133.5±7.0 cm3

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