ChemSpider 2D Image | (1E,2E,4E,6R,7R)-8-Bromo-6,7-dichloro-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,4-octadien-1-imine | C17H15BrCl2F5NO

(1E,2E,4E,6R,7R)-8-Bromo-6,7-dichloro-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,4-octadien-1-imine

  • Molecular FormulaC17H15BrCl2F5NO
  • Average mass495.109 Da
  • Monoisotopic mass492.963409 Da
  • ChemSpider ID129306064

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1E,2E,4E,6R,7R)-8-Brom-6,7-dichlor-3,7-dimethyl-N-[(pentafluorbenzyl)oxy]-2,4-octadien-1-imin [German] [ACD/IUPAC Name]
(1E,2E,4E,6R,7R)-8-Bromo-6,7-dichloro-3,7-dimethyl-N-[(pentafluorobenzyl)oxy]-2,4-octadien-1-imine [ACD/IUPAC Name]
(1E,2E,4E,6R,7R)-8-Bromo-6,7-dichloro-3,7-diméthyl-N-[(pentafluorobenzyl)oxy]-2,4-octadién-1-imine [French] [ACD/IUPAC Name]
2,4-Octadienal, 8-bromo-6,7-dichloro-3,7-dimethyl-, O-[(2,3,4,5,6-pentafluorophenyl)methyl]oxime, (1E,2E,4E,6R,7R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 471.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 238.8±31.5 °C
Index of Refraction: 1.498
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.09
ACD/LogD (pH 5.5): 6.13
ACD/BCF (pH 5.5): 26661.57
ACD/KOC (pH 5.5): 51242.91
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 26661.57
ACD/KOC (pH 7.4): 51242.91
Polar Surface Area: 22 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 30.8±7.0 dyne/cm
Molar Volume: 338.2±7.0 cm3

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