ChemSpider 2D Image | 4-Amino-1-(beta-D-glycero-pentofuranosyl)-2(1H)-pyrimidinone | C9H13N3O5

4-Amino-1-(β-D-glycero-pentofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H13N3O5
  • Average mass243.217 Da
  • Monoisotopic mass243.085526 Da
  • ChemSpider ID21111837
  • defined stereocentres - 2 of 4 defined stereocentres


More details:






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

2(1H)-Pyrimidinone, 4-amino-1-β-D-glycero-pentofuranosyl- [ACD/Index Name]
4-Amino-1-((2R,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
4-Amino-1-(β-D-glycero-pentofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-(β-D-glycero-pentofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-(β-D-glycéro-pentofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
1-(b-D-Arabinofuranosyl)cytosine
147-94-4 [RN]
201996-57-8 [RN]
478511-19-2 [RN]
4-Amino-1-(b-D-Arabinofuranosyl)-2(1H)pyrimidinone
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.9±0.1 g/cm3
Boiling Point: 545.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.8±6.0 kJ/mol
Flash Point: 283.8±32.9 °C
Index of Refraction: 1.756
Molar Refractivity: 52.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.93
ACD/LogD (pH 5.5): -2.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.50
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.54
Polar Surface Area: 129 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 89.6±7.0 dyne/cm
Molar Volume: 128.4±7.0 cm3

Click to predict properties on the Chemicalize site






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