ChemSpider 2D Image | 9-(2-Deoxy-2-fluoropentofuranosyl)-1,9-dihydro-6H-purin-6-one | C10H11FN4O4

9-(2-Deoxy-2-fluoropentofuranosyl)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC10H11FN4O4
  • Average mass270.217 Da
  • Monoisotopic mass270.076447 Da
  • ChemSpider ID13900437

More details:

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

6H-Purin-6-one, 9-(2-deoxy-2-fluoropentofuranosyl)-1,9-dihydro- [ACD/Index Name]
9-(2-Deoxy-2-fluoropentofuranosyl)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
9-(2-Désoxy-2-fluoropentofuranosyl)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
9-(2-Desoxy-2-fluorpentofuranosyl)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
9-(3-Fluoro-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1,9-dihydro-purin-6-one
80049-87-2 [RN]
9-(3-Fluoro-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-9H-purin-6-ol
9-[3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol
98983-40-5 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 744.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 404.2±32.9 °C
Index of Refraction: 1.810
Molar Refractivity: 57.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.13
ACD/LogD (pH 5.5): -1.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.78
ACD/LogD (pH 7.4): -1.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.69
Polar Surface Area: 109 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 83.4±7.0 dyne/cm
Molar Volume: 134.3±7.0 cm3

Click to predict properties on the Chemicalize site


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