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Search term: STNMPEICBMBFAP (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Xylitol pentanitrate | C5H7N5O15

Xylitol pentanitrate

  • Molecular FormulaC5H7N5O15
  • Average mass377.134 Da
  • Monoisotopic mass376.993866 Da
  • ChemSpider ID29852477

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1,2,3,4,5-Penta-O-nitro-D-xylitol [German] [ACD/IUPAC Name]
1,2,3,4,5-Penta-O-nitro-D-xylitol [ACD/IUPAC Name]
1,2,3,4,5-Penta-O-nitro-D-xylitol [French] [ACD/IUPAC Name]
D-Xylitol, pentanitrate [ACD/Index Name]
Xylitol pentanitrate [Wiki]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 461.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 207.1±30.7 °C
Index of Refraction: 1.527
Molar Refractivity: 63.9±0.3 cm3
#H bond acceptors: 20
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.54
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 954.19
ACD/KOC (pH 5.5): 4725.23
ACD/LogD (pH 7.4): 4.22
ACD/BCF (pH 7.4): 954.19
ACD/KOC (pH 7.4): 4725.23
Polar Surface Area: 275 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 76.2±3.0 dyne/cm
Molar Volume: 207.9±3.0 cm3

Click to predict properties on the Chemicalize site


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