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

2-Amino-1-(β-D-arabinofuranosyl)-4(1H)-pyrimidinone

  • Molecular FormulaC9H13N3O5
  • Average mass243.217 Da
  • Monoisotopic mass243.085526 Da
  • ChemSpider ID57380915

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-Amino-1-(β-D-arabinofuranosyl)-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
2-Amino-1-(β-D-arabinofuranosyl)-4(1H)-pyrimidinone [ACD/IUPAC Name]
2-Amino-1-(β-D-arabinofuranosyl)-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
4(1H)-Pyrimidinone, 2-amino-1-β-D-arabinofuranosyl- [ACD/Index Name]
10212-30-3 [RN]
2-Amino-1-((2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-4(1H)-one
Arabinoisocytidine
MFCD25542473
OC[C@H]1O[C@@H](N2C=CC(N=C2N)=O)[C@@H](O)[C@@H]1O

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

    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): -2.14
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.63
    ACD/LogD (pH 7.4): -2.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.63
    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


    Advertisement