ChemSpider 2D Image | 1-[(2R,5S)-5-(Hydroxymethyl)-2,5-dihydro-2-furanyl]-5-(~2~H_3_)methyl-2,4(1H,3H)-(6-~2~H)pyrimidinedione | C10H8D4N2O4

1-[(2R,5S)-5-(Hydroxymethyl)-2,5-dihydro-2-furanyl]-5-(2H3)methyl-2,4(1H,3H)-(6-2H)pyrimidinedione

  • Molecular FormulaC10H8D4N2O4
  • Average mass228.238 Da
  • Monoisotopic mass228.104813 Da
  • ChemSpider ID60497963

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-[(2R,5S)-5-(Hydroxymethyl)-2,5-dihydro-2-furanyl]-5-(2H3)methyl-2,4(1H,3H)-(6-2H)pyrimidindion [German] [ACD/IUPAC Name]
1-[(2R,5S)-5-(Hydroxymethyl)-2,5-dihydro-2-furanyl]-5-(2H3)methyl-2,4(1H,3H)-(6-2H)pyrimidinedione [ACD/IUPAC Name]
1-[(2R,5S)-5-(Hydroxyméthyl)-2,5-dihydro-2-furanyl]-5-(2H3)méthyl-2,4(1H,3H)-(6-2H)pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione-6-d, 1-[(2R,5S)-2,5-dihydro-5-(hydroxymethyl)-2-furanyl]-5-(methyl-d3)- [ACD/Index Name]
1219803-67-4 [RN]
2',3'-Anhydrothymidine
2',3'-Didehydro-3'-deoxythymidine
Stavudine-α,α,α,6-d4

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.575
Molar Refractivity: 53.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.86
ACD/LogD (pH 5.5): -0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.29
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.20
Polar Surface Area: 79 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 163.1±3.0 cm3

Click to predict properties on the Chemicalize site


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