ChemSpider 2D Image | (1S)-1-(8-Amino[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-D-ribitol | C10H13N5O4

(1S)-1-(8-Amino[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-D-ribitol

  • Molecular FormulaC10H13N5O4
  • Average mass267.241 Da
  • Monoisotopic mass267.096741 Da
  • ChemSpider ID34225068

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1S)-1-(8-Amino[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-D-ribitol [German] [ACD/IUPAC Name]
(1S)-1-(8-Amino[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-D-ribitol [ACD/IUPAC Name]
(1S)-1-(8-Amino[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 1-C-(8-amino-1,2,4-triazolo[4,3-b]pyridazin-3-yl)-1,4-anhydro-, (1S)- [ACD/Index Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.907
Molar Refractivity: 60.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.86
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.20
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.56
Polar Surface Area: 139 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 107.6±7.0 dyne/cm
Molar Volume: 128.2±7.0 cm3

Click to predict properties on the Chemicalize site


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