ChemSpider 2D Image | 1-(beta-D-Ribofuranosyl)-2(1H)-pyrimidinone | C9H12N2O5

1-(β-D-Ribofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H12N2O5
  • Average mass228.202 Da
  • Monoisotopic mass228.074615 Da
  • ChemSpider ID21475110

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1-(β-D-Ribofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
1-(β-D-Ribofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
1-(β-D-Ribofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 1-β-D-ribofuranosyl- [ACD/Index Name]
1-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
1-b-D-Ribofuranosyl-2(1H)-pyrimidinone
2-pyrimidone-1-??-d-riboside
3690-10-6 [RN]
MFCD04973699 [MDL number]
Zebularine
  • Miscellaneous

    • Bio Activity:

      DNA methyltransferase and cytidine deaminase inhibitor Tocris Bioscience [2293]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 499.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.4±6.0 kJ/mol
Flash Point: 255.6±31.5 °C
Index of Refraction: 1.697
Molar Refractivity: 50.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.31
ACD/LogD (pH 5.5): -1.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.69
ACD/LogD (pH 7.4): -1.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.69
Polar Surface Area: 103 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 75.5±7.0 dyne/cm
Molar Volume: 131.6±7.0 cm3

Click to predict properties on the Chemicalize site


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