ChemSpider 2D Image | N,N-Diethyl-7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonamide | C12H16N2O6S

N,N-Diethyl-7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

  • Molecular FormulaC12H16N2O6S
  • Average mass316.330 Da
  • Monoisotopic mass316.072906 Da
  • ChemSpider ID28637072

More details:

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

1,4-Benzodioxin-6-sulfonamide, N,N-diethyl-2,3-dihydro-7-nitro- [ACD/Index Name]
N,N-Diethyl-7-nitro-2,3-dihydro-1,4-benzodioxin-6-sulfonamid [German] [ACD/IUPAC Name]
N,N-Diethyl-7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [ACD/IUPAC Name]
N,N-Diéthyl-7-nitro-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 463.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.5±3.0 kJ/mol
Flash Point: 234.3±31.5 °C
Index of Refraction: 1.567
Molar Refractivity: 74.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 50.17
ACD/KOC (pH 5.5): 573.85
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 50.17
ACD/KOC (pH 7.4): 573.85
Polar Surface Area: 110 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 228.7±3.0 cm3

Click to predict properties on the Chemicalize site


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