ChemSpider 2D Image | 3-(3-Amino-2-hydroxy-3-oxopropyl)-1-(2-deoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione | C13H19N3O7

3-(3-Amino-2-hydroxy-3-oxopropyl)-1-(2-deoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC13H19N3O7
  • Average mass329.306 Da
  • Monoisotopic mass329.122314 Da
  • ChemSpider ID28574919

More details:

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

2,4(1H,3H)-Pyrimidinedione, 3-(3-amino-2-hydroxy-3-oxopropyl)-1-(2-deoxypentofuranosyl)-5-methyl- [ACD/Index Name]
3-(3-Amino-2-hydroxy-3-oxopropyl)-1-(2-deoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
3-(3-Amino-2-hydroxy-3-oxopropyl)-1-(2-desoxypentofuranosyl)-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
3-(3-Amino-2-hydroxy-3-oxopropyl)-1-(2-désoxypentofuranosyl)-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
826995-08-8 [RN]
THYMIDINE, 3-(3-AMINO-2-HYDROXY-3-OXOPROPYL)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 654.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 110.4±6.0 kJ/mol
Flash Point: 349.7±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 75.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.64
ACD/LogD (pH 5.5): -1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.57
ACD/LogD (pH 7.4): -1.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.57
Polar Surface Area: 154 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 77.5±3.0 dyne/cm
Molar Volume: 214.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement