ChemSpider 2D Image | 1-[(2R,3aR,7aS)-3a-Hydroxy-7a-(hydroxymethyl)hexahydro-2H-furo[2,3-c]pyran-2-yl]-5-methyl-2,4(1H,3H)-pyrimidinedione | C13H18N2O6

1-[(2R,3aR,7aS)-3a-Hydroxy-7a-(hydroxymethyl)hexahydro-2H-furo[2,3-c]pyran-2-yl]-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC13H18N2O6
  • Average mass298.292 Da
  • Monoisotopic mass298.116486 Da
  • ChemSpider ID30658895

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-[(2R,3aR,7aS)-3a-Hydroxy-7a-(hydroxymethyl)hexahydro-2H-furo[2,3-c]pyran-2-yl]-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-[(2R,3aR,7aS)-3a-Hydroxy-7a-(hydroxymethyl)hexahydro-2H-furo[2,3-c]pyran-2-yl]-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-[(2R,3aR,7aS)-3a-Hydroxy-7a-(hydroxyméthyl)hexahydro-2H-furo[2,3-c]pyran-2-yl]-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(2R,3aR,7aS)-hexahydro-3a-hydroxy-7a-(hydroxymethyl)-2H-furo[2,3-c]pyran-2-yl]-5-methyl- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.610
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.38
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.45
ACD/LogD (pH 7.4): -0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.37
Polar Surface Area: 108 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 69.9±3.0 dyne/cm
Molar Volume: 199.3±3.0 cm3

Click to predict properties on the Chemicalize site


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