ChemSpider 2D Image | 4-{[2-(Diethylamino)-4-methylpentyl]amino}-N-methyl-3-nitrobenzenesulfonamide | C17H30N4O4S

4-{[2-(Diethylamino)-4-methylpentyl]amino}-N-methyl-3-nitrobenzenesulfonamide

  • Molecular FormulaC17H30N4O4S
  • Average mass386.509 Da
  • Monoisotopic mass386.198761 Da
  • ChemSpider ID21704590

More details:

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

4-{[2-(Diethylamino)-4-methylpentyl]amino}-N-methyl-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
4-{[2-(Diéthylamino)-4-méthylpentyl]amino}-N-méthyl-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
4-{[2-(Diethylamino)-4-methylpentyl]amino}-N-methyl-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[2-(diethylamino)-4-methylpentyl]amino]-N-methyl-3-nitro- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 519.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 267.7±32.9 °C
Index of Refraction: 1.545
Molar Refractivity: 103.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.31
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 1.56
ACD/KOC (pH 7.4): 9.52
Polar Surface Area: 116 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 327.9±3.0 cm3

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