ChemSpider 2D Image | 4-[(2-Amino-3-methoxy-2-methylpropyl)amino]-N-methyl-3-nitrobenzenesulfonamide | C12H20N4O5S

4-[(2-Amino-3-methoxy-2-methylpropyl)amino]-N-methyl-3-nitrobenzenesulfonamide

  • Molecular FormulaC12H20N4O5S
  • Average mass332.376 Da
  • Monoisotopic mass332.115448 Da
  • ChemSpider ID30220168

More details:

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

4-[(2-Amino-3-methoxy-2-methylpropyl)amino]-N-methyl-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
4-[(2-Amino-3-méthoxy-2-méthylpropyl)amino]-N-méthyl-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
4-[(2-Amino-3-methoxy-2-methylpropyl)amino]-N-methyl-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[(2-amino-3-methoxy-2-methylpropyl)amino]-N-methyl-3-nitro- [ACD/Index Name]
4-[(2-AMINO-3-METHOXY-2-METHYLPROPYL)AMINO]-N-METHYL-3-NITROBENZENE-1-SULFONAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 540.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 280.9±32.9 °C
Index of Refraction: 1.577
Molar Refractivity: 82.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): -1.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.30
Polar Surface Area: 148 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 247.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement