ChemSpider 2D Image | N-(5-{[(3-Nitrophenyl)sulfonyl]amino}-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide | C19H16N4O8S2

N-(5-{[(3-Nitrophenyl)sulfonyl]amino}-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

  • Molecular FormulaC19H16N4O8S2
  • Average mass492.482 Da
  • Monoisotopic mass492.040955 Da
  • ChemSpider ID66697396

More details:

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

1,4-Benzodioxin-6-sulfonamide, 2,3-dihydro-N-[5-[[(3-nitrophenyl)sulfonyl]amino]-2-pyridinyl]- [ACD/Index Name]
N-(5-{[(3-Nitrophenyl)sulfonyl]amino}-2-pyridinyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamid [German] [ACD/IUPAC Name]
N-(5-{[(3-Nitrophenyl)sulfonyl]amino}-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [ACD/IUPAC Name]
N-(5-{[(3-Nitrophényl)sulfonyl]amino}-2-pyridinyl)-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: 1.6±0.1 g/cm3
Boiling Point: 716.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 387.4±35.7 °C
Index of Refraction: 1.693
Molar Refractivity: 115.6±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 35.41
ACD/KOC (pH 5.5): 433.50
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 3.38
ACD/KOC (pH 7.4): 41.39
Polar Surface Area: 186 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 81.3±3.0 dyne/cm
Molar Volume: 301.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement