ChemSpider 2D Image | N-[3,5-Bis(trifluoromethyl)phenyl]-N~2~-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoyl]norleucinamide | C26H28F6N2O4

N-[3,5-Bis(trifluoromethyl)phenyl]-N2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoyl]norleucinamide

  • Molecular FormulaC26H28F6N2O4
  • Average mass546.502 Da
  • Monoisotopic mass546.195313 Da
  • ChemSpider ID120738025

More details:

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

1,4-Benzodioxin-6-butanamide, N-[1-[[[3,5-bis(trifluoromethyl)phenyl]amino]carbonyl]pentyl]-2,3-dihydro- [ACD/Index Name]
N-[3,5-Bis(trifluormethyl)phenyl]-N2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoyl]norleucinamid [German] [ACD/IUPAC Name]
N-[3,5-Bis(trifluoromethyl)phenyl]-N2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoyl]norleucinamide [ACD/IUPAC Name]
N-[3,5-Bis(trifluorométhyl)phényl]-N2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoyl]norleucinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 632.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.2±31.5 °C
Index of Refraction: 1.517
Molar Refractivity: 126.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 5.71
ACD/BCF (pH 5.5): 12776.54
ACD/KOC (pH 5.5): 30266.27
ACD/LogD (pH 7.4): 5.71
ACD/BCF (pH 7.4): 12776.46
ACD/KOC (pH 7.4): 30266.07
Polar Surface Area: 77 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 417.5±3.0 cm3

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