ChemSpider 2D Image | 1-Nitro-1-[(1-nitropropyl)disulfanyl]propane | C6H12N2O4S2

1-Nitro-1-[(1-nitropropyl)disulfanyl]propane

  • Molecular FormulaC6H12N2O4S2
  • Average mass240.301 Da
  • Monoisotopic mass240.023849 Da
  • ChemSpider ID35764326

More details:

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

1-Nitro-1-[(1-nitropropyl)disulfanyl]propan [German] [ACD/IUPAC Name]
1-Nitro-1-[(1-nitropropyl)disulfanyl]propane [ACD/IUPAC Name]
1-Nitro-1-[(1-nitropropyl)disulfanyl]propane [French] [ACD/IUPAC Name]
Disulfide, bis(1-nitropropyl) [ACD/Index Name]
26551-29-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 320.9±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.3±3.0 kJ/mol
Flash Point: 147.9±23.7 °C
Index of Refraction: 1.549
Molar Refractivity: 57.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 15.47
ACD/KOC (pH 5.5): 155.19
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 142 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 50.2±3.0 dyne/cm
Molar Volume: 181.8±3.0 cm3

Click to predict properties on the Chemicalize site


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