ChemSpider 2D Image | 7-Nitro-N-(tetrahydro-2-furanylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide | C13H16N2O7S

7-Nitro-N-(tetrahydro-2-furanylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

  • Molecular FormulaC13H16N2O7S
  • Average mass344.340 Da
  • Monoisotopic mass344.067810 Da
  • ChemSpider ID28637071

More details:

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

1,4-Benzodioxin-6-sulfonamide, 2,3-dihydro-7-nitro-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
7-Nitro-N-(tetrahydro-2-furanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamid [German] [ACD/IUPAC Name]
7-Nitro-N-(tetrahydro-2-furanylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [ACD/IUPAC Name]
7-Nitro-N-(tétrahydro-2-furanylméthyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [French] [ACD/IUPAC Name]
7-nitro-N-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
7-nitro-N-[(oxolan-2-yl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 536.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 278.2±32.9 °C
Index of Refraction: 1.580
Molar Refractivity: 78.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.62
ACD/KOC (pH 5.5): 248.79
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.38
ACD/KOC (pH 7.4): 229.10
Polar Surface Area: 128 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 236.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement