ChemSpider 2D Image | N-(3,3,3-Trifluoro-2-hydroxy-2-phenylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide | C17H16F3NO5S

N-(3,3,3-Trifluoro-2-hydroxy-2-phenylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

  • Molecular FormulaC17H16F3NO5S
  • Average mass403.373 Da
  • Monoisotopic mass403.070129 Da
  • ChemSpider ID30741509

More details:

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

1,4-Benzodioxin-6-sulfonamide, 2,3-dihydro-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)- [ACD/Index Name]
N-(3,3,3-Trifluor-2-hydroxy-2-phenylpropyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamid [German] [ACD/IUPAC Name]
N-(3,3,3-Trifluoro-2-hydroxy-2-phenylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [ACD/IUPAC Name]
N-(3,3,3-Trifluoro-2-hydroxy-2-phénylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide [French] [ACD/IUPAC Name]
1351634-51-9 [RN]
N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-sulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 550.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 286.6±32.9 °C
Index of Refraction: 1.565
Molar Refractivity: 90.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 455.80
ACD/KOC (pH 5.5): 2784.53
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 454.86
ACD/KOC (pH 7.4): 2778.78
Polar Surface Area: 93 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 48.0±3.0 dyne/cm
Molar Volume: 277.4±3.0 cm3

Click to predict properties on the Chemicalize site


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