ChemSpider 2D Image | 4-(3,7-Dimethyl-4-oxo[1,2]oxazolo[4,5-d]pyridazin-5(4H)-yl)benzenesulfonamide | C13H12N4O4S

4-(3,7-Dimethyl-4-oxo[1,2]oxazolo[4,5-d]pyridazin-5(4H)-yl)benzenesulfonamide

  • Molecular FormulaC13H12N4O4S
  • Average mass320.324 Da
  • Monoisotopic mass320.057922 Da
  • ChemSpider ID30656982

More details:

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

4-(3,7-Dimethyl-4-oxo[1,2]oxazolo[4,5-d]pyridazin-5(4H)-yl)benzenesulfonamide [ACD/IUPAC Name]
4-(3,7-Diméthyl-4-oxo[1,2]oxazolo[4,5-d]pyridazin-5(4H)-yl)benzènesulfonamide [French] [ACD/IUPAC Name]
4-(3,7-Dimethyl-4-oxo[1,2]oxazolo[4,5-d]pyridazin-5(4H)-yl)benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-(3,7-dimethyl-4-oxoisoxazolo[4,5-d]pyridazin-5(4H)-yl)- [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: 613.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.7±34.3 °C
Index of Refraction: 1.734
Molar Refractivity: 78.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.34
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.37
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.33
Polar Surface Area: 127 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 68.8±7.0 dyne/cm
Molar Volume: 195.7±7.0 cm3

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