ChemSpider 2D Image | 1,4:3,6-Dianhydro-2,5-dideoxy-2,2,5,5-tetranitro-L-threo-hexitol | C6H6N4O10

1,4:3,6-Dianhydro-2,5-dideoxy-2,2,5,5-tetranitro-L-threo-hexitol

  • Molecular FormulaC6H6N4O10
  • Average mass294.133 Da
  • Monoisotopic mass294.008392 Da
  • ChemSpider ID24731731

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,4:3,6-Dianhydro-2,5-dideoxy-2,2,5,5-tetranitro-L-threo-hexitol [ACD/IUPAC Name]
1,4:3,6-Dianhydro-2,5-didesoxy-2,2,5,5-tetranitro-L-threo-hexitol [German] [ACD/IUPAC Name]
1,4:3,6-Dianhydro-2,5-didésoxy-2,2,5,5-tétranitro-L-thréo-hexitol [French] [ACD/IUPAC Name]
L-threo-Hexitol, 1,4:3,6-dianhydro-2,5-dideoxy-2,2,5,5-tetranitro- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 609.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 317.8±33.5 °C
Index of Refraction: 1.609
Molar Refractivity: 53.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 2.73
ACD/BCF (pH 5.5): 69.83
ACD/KOC (pH 5.5): 727.04
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 69.83
ACD/KOC (pH 7.4): 727.04
Polar Surface Area: 202 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 90.9±5.0 dyne/cm
Molar Volume: 154.1±5.0 cm3

Click to predict properties on the Chemicalize site


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