ChemSpider 2D Image | N-[2-(Diethylamino)ethyl]-3-methoxybenzenesulfonamide | C13H22N2O3S

N-[2-(Diethylamino)ethyl]-3-methoxybenzenesulfonamide

  • Molecular FormulaC13H22N2O3S
  • Average mass286.390 Da
  • Monoisotopic mass286.135101 Da
  • ChemSpider ID31142985

More details:






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

Benzenesulfonamide, N-[2-(diethylamino)ethyl]-3-methoxy- [ACD/Index Name]
N-[2-(Diethylamino)ethyl]-3-methoxybenzenesulfonamide [ACD/IUPAC Name]
N-[2-(Diethylamino)ethyl]-3-Methoxy-Benzenesulfonamide
N-[2-(Diéthylamino)éthyl]-3-méthoxybenzènesulfonamide [French] [ACD/IUPAC Name]
N-[2-(Diethylamino)ethyl]-3-methoxybenzolsulfonamid [German] [ACD/IUPAC Name]
10.1021/jm400990p
B3V

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 411.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 202.8±31.5 °C
Index of Refraction: 1.521
Molar Refractivity: 77.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -0.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.02
Polar Surface Area: 67 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 253.8±3.0 cm3

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