ChemSpider 2D Image | 4-[(3-Nitrophenyl)(vinylsulfonyl)amino]-N-(2-pyrimidinyl)benzenesulfonamide | C18H15N5O6S2

4-[(3-Nitrophenyl)(vinylsulfonyl)amino]-N-(2-pyrimidinyl)benzenesulfonamide

  • Molecular FormulaC18H15N5O6S2
  • Average mass461.472 Da
  • Monoisotopic mass461.046387 Da
  • ChemSpider ID102796706

More details:

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

4-[(3-Nitrophenyl)(vinylsulfonyl)amino]-N-(2-pyrimidinyl)benzenesulfonamide [ACD/IUPAC Name]
4-[(3-Nitrophényl)(vinylsulfonyl)amino]-N-(2-pyrimidinyl)benzènesulfonamide [French] [ACD/IUPAC Name]
4-[(3-Nitrophenyl)(vinylsulfonyl)amino]-N-(2-pyrimidinyl)benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[(ethenylsulfonyl)(3-nitrophenyl)amino]-N-2-pyrimidinyl- [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: 707.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.5±3.0 kJ/mol
Flash Point: 381.9±35.7 °C
Index of Refraction: 1.687
Molar Refractivity: 112.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 14.16
ACD/KOC (pH 5.5): 193.20
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.59
Polar Surface Area: 172 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 80.5±3.0 dyne/cm
Molar Volume: 294.0±3.0 cm3

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