ChemSpider 2D Image | 4-Amino-1-[2-deoxy-2-(fluoromethyl)-alpha-D-arabinofuranosyl]-2(1H)-pyrimidinone | C10H14FN3O4

4-Amino-1-[2-deoxy-2-(fluoromethyl)-α-D-arabinofuranosyl]-2(1H)-pyrimidinone

  • Molecular FormulaC10H14FN3O4
  • Average mass259.234 Da
  • Monoisotopic mass259.096832 Da
  • ChemSpider ID111308188
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

2(1H)-Pyrimidinone, 4-amino-1-[2-deoxy-2-(fluoromethyl)-α-D-arabinofuranosyl]- [ACD/Index Name]
4-Amino-1-[2-deoxy-2-(fluoromethyl)-α-D-arabinofuranosyl]-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-[2-desoxy-2-(fluormethyl)-α-D-arabinofuranosyl]-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-[2-désoxy-2-(fluorométhyl)-α-D-arabinofuranosyl]-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 519.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.2±6.0 kJ/mol
Flash Point: 268.2±32.9 °C
Index of Refraction: 1.673
Molar Refractivity: 56.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.35
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.89
ACD/LogD (pH 7.4): -1.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.02
Polar Surface Area: 108 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 66.2±7.0 dyne/cm
Molar Volume: 150.2±7.0 cm3

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