ChemSpider 2D Image | 1-(2-Deoxy-beta-D-threo-pentofuranosyl)-2(1H)-pyrimidinone | C9H12N2O4

1-(2-Deoxy-β-D-threo-pentofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H12N2O4
  • Average mass212.203 Da
  • Monoisotopic mass212.079712 Da
  • ChemSpider ID58780584

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-(2-Deoxy-β-D-threo-pentofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
1-(2-Desoxy-β-D-threo-pentofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
1-(2-Désoxy-β-D-thréo-pentofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 1-(2-deoxy-β-D-threo-pentofuranosyl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 450.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.8±6.0 kJ/mol
Flash Point: 226.1±31.5 °C
Index of Refraction: 1.665
Molar Refractivity: 49.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.25
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.94
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.95
Polar Surface Area: 82 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 65.6±7.0 dyne/cm
Molar Volume: 134.3±7.0 cm3

Click to predict properties on the Chemicalize site


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