ChemSpider 2D Image | (4E,8E)-4,8-Dimethyl-2-azabicyclo[9.2.2]pentadeca-1(13),4,8,11,14-pentaene | C16H21N

(4E,8E)-4,8-Dimethyl-2-azabicyclo[9.2.2]pentadeca-1(13),4,8,11,14-pentaene

  • Molecular FormulaC16H21N
  • Average mass227.345 Da
  • Monoisotopic mass227.167404 Da
  • ChemSpider ID35033634
  • Double-bond stereo - Double-bond stereo


More details:






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

(4E,8E)-4,8-Dimethyl-2-azabicyclo[9.2.2]pentadeca-1(13),4,8,11,14-pentaen [German] [ACD/IUPAC Name]
(4E,8E)-4,8-Dimethyl-2-azabicyclo[9.2.2]pentadeca-1(13),4,8,11,14-pentaene [ACD/IUPAC Name]
(4E,8E)-4,8-Diméthyl-2-azabicyclo[9.2.2]pentadéca-1(13),4,8,11,14-pentaène [French] [ACD/IUPAC Name]
2-Azabicyclo[9.2.2]pentadeca-4,8,11,13,14-pentaene, 4,8-dimethyl-, (4E,8E)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 359.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 178.3±23.3 °C
Index of Refraction: 1.515
Molar Refractivity: 73.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2812.07
ACD/KOC (pH 5.5): 9850.23
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 3220.33
ACD/KOC (pH 7.4): 11280.31
Polar Surface Area: 12 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 29.8±3.0 dyne/cm
Molar Volume: 243.5±3.0 cm3

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