ChemSpider 2D Image | (4aR,6R,7R,7aS)-6-(3H-Diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide | C11H11N6O6P

(4aR,6R,7R,7aS)-6-(3H-Diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide

  • Molecular FormulaC11H11N6O6P
  • Average mass354.215 Da
  • Monoisotopic mass354.047760 Da
  • ChemSpider ID62987923
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(4aR,6R,7R,7aS) 2-Oxyde de 6-(3H-diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tétrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol [French] [ACD/IUPAC Name]
(4aR,6R,7R,7aS)-6-(3H-Diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2,7-diol-2-oxid [German] [ACD/IUPAC Name]
(4aR,6R,7R,7aS)-6-(3H-Diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide [ACD/IUPAC Name]
4H-Furo[3,2-d]-1,3,2-dioxaphosphorin-7-ol, 6-(3H-diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-2-hydroxy-, 2-oxide, (4aR,6R,7R,7aS)- [ACD/Index Name]
50663-90-6 [RN]

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

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 2.102
Molar Refractivity: 74.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 156 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 164.7±7.0 dyne/cm
Molar Volume: 139.3±7.0 cm3

Click to predict properties on the Chemicalize site






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