ChemSpider 2D Image | 1,4-Bis(methylsulfonyl)-2,3-dinitrosobutane | C6H12N2O6S2

1,4-Bis(methylsulfonyl)-2,3-dinitrosobutane

  • Molecular FormulaC6H12N2O6S2
  • Average mass272.299 Da
  • Monoisotopic mass272.013672 Da
  • ChemSpider ID114409079

More details:

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

1,4-Bis(methylsulfonyl)-2,3-dinitrosobutan [German] [ACD/IUPAC Name]
1,4-Bis(methylsulfonyl)-2,3-dinitrosobutane [ACD/IUPAC Name]
1,4-Bis(méthylsulfonyl)-2,3-dinitrosobutane [French] [ACD/IUPAC Name]
Butane, 1,4-bis(methylsulfonyl)-2,3-dinitroso- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 532.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 275.8±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 57.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.39
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.31
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.31
Polar Surface Area: 144 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 62.6±7.0 dyne/cm
Molar Volume: 172.1±7.0 cm3

Click to predict properties on the Chemicalize site


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