ChemSpider 2D Image | 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}propanamide | C21H21F4NO4

2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}propanamide

  • Molecular FormulaC21H21F4NO4
  • Average mass427.389 Da
  • Monoisotopic mass427.140686 Da
  • ChemSpider ID31816722

More details:

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

1,4-Benzodioxin-6-acetamide, 2,3-dihydro-α-methyl-N-[3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl]- [ACD/Index Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}propanamide [ACD/IUPAC Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-{3-[(2,2,3,3-tétrafluoropropoxy)méthyl]phényl}propanamide [French] [ACD/IUPAC Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-{3-[(2,2,3,3-tetrafluorpropoxy)methyl]phenyl}propanamid [German] [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: 547.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 285.1±30.1 °C
Index of Refraction: 1.540
Molar Refractivity: 101.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 411.14
ACD/KOC (pH 5.5): 2586.41
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 411.14
ACD/KOC (pH 7.4): 2586.42
Polar Surface Area: 57 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 323.8±3.0 cm3

Click to predict properties on the Chemicalize site


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