ChemSpider 2D Image | 3-Bromo-1-(D-ribofuranosyl)-1H-pyrrolo[2,3-d]pyridazin-4-amine | C11H13BrN4O4

3-Bromo-1-(D-ribofuranosyl)-1H-pyrrolo[2,3-d]pyridazin-4-amine

  • Molecular FormulaC11H13BrN4O4
  • Average mass345.149 Da
  • Monoisotopic mass344.012024 Da
  • ChemSpider ID24675918

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1H-Pyrrolo[2,3-d]pyridazin-4-amine, 3-bromo-1-D-ribofuranosyl- [ACD/Index Name]
3-Brom-1-(D-ribofuranosyl)-1H-pyrrolo[2,3-d]pyridazin-4-amin [German] [ACD/IUPAC Name]
3-Bromo-1-(D-ribofuranosyl)-1H-pyrrolo[2,3-d]pyridazin-4-amine [ACD/IUPAC Name]
3-Bromo-1-(D-ribofuranosyl)-1H-pyrrolo[2,3-d]pyridazin-4-amine [French] [ACD/IUPAC Name]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 772.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.0±3.0 kJ/mol
Flash Point: 421.0±32.9 °C
Index of Refraction: 1.870
Molar Refractivity: 69.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -0.22
ACD/LogD (pH 5.5): -1.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.07
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.04
Polar Surface Area: 127 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 95.3±7.0 dyne/cm
Molar Volume: 152.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement