ChemSpider 2D Image | (1E,2E)-4,6-Dibromo-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,7-octadien-1-imine | C17H16Br2F5NO

(1E,2E)-4,6-Dibromo-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,7-octadien-1-imine

  • Molecular FormulaC17H16Br2F5NO
  • Average mass505.115 Da
  • Monoisotopic mass502.951874 Da
  • ChemSpider ID17342818
  • Double-bond stereo - Double-bond stereo


More details:






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

(1E,2E)-4,6-Dibrom-3,7-dimethyl-N-[(pentafluorbenzyl)oxy]-2,7-octadien-1-imin [German] [ACD/IUPAC Name]
(1E,2E)-4,6-Dibromo-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,7-octadien-1-imine [ACD/IUPAC Name]
(1E,2E)-4,6-Dibromo-3,7-diméthyl-N-[(pentafluorobenzyl)oxy]-2,7-octadién-1-imine [French] [ACD/IUPAC Name]
2,7-Octadienal, 4,6-dibromo-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (1E,2E)- [ACD/Index Name]
2,7-Octadienal, 4,6-dibromo-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (2E)-
935694-32-9 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 464.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.8±3.0 kJ/mol
Flash Point: 234.8±31.5 °C
Index of Refraction: 1.505
Molar Refractivity: 96.7±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28267.96
ACD/KOC (pH 5.5): 53434.45
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28267.96
ACD/KOC (pH 7.4): 53434.45
Polar Surface Area: 22 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 29.6±7.0 dyne/cm
Molar Volume: 325.9±7.0 cm3

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