ChemSpider 2D Image | N-(3-Fluoro-4-methoxyphenyl)-2,4,6-triisopropylbenzenesulfonamide | C22H30FNO3S

N-(3-Fluoro-4-methoxyphenyl)-2,4,6-triisopropylbenzenesulfonamide

  • Molecular FormulaC22H30FNO3S
  • Average mass407.542 Da
  • Monoisotopic mass407.193054 Da
  • ChemSpider ID75882099

More details:






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

Benzenesulfonamide, N-(3-fluoro-4-methoxyphenyl)-2,4,6-tris(1-methylethyl)- [ACD/Index Name]
N-(3-Fluor-4-methoxyphenyl)-2,4,6-triisopropylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-(3-Fluoro-4-methoxyphenyl)-2,4,6-triisopropylbenzenesulfonamide [ACD/IUPAC Name]
N-(3-Fluoro-4-méthoxyphényl)-2,4,6-triisopropylbenzènesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 482.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 245.7±31.5 °C
Index of Refraction: 1.540
Molar Refractivity: 112.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.99
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20285.92
ACD/KOC (pH 5.5): 42119.63
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 18086.71
ACD/KOC (pH 7.4): 37553.41
Polar Surface Area: 64 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 357.0±3.0 cm3

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