ChemSpider 2D Image | 1-(11,14-Dimethyl-6,14-diazapentacyclo[7.6.2.0~2,7~.0~2,13~.0~13,17~]heptadec-7-en-6-yl)ethanone | C19H28N2O

1-(11,14-Dimethyl-6,14-diazapentacyclo[7.6.2.02,7.02,13.013,17]heptadec-7-en-6-yl)ethanone

  • Molecular FormulaC19H28N2O
  • Average mass300.438 Da
  • Monoisotopic mass300.220154 Da
  • ChemSpider ID28287832

More details:



Featured data source



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

1-(11,14-Dimethyl-6,14-diazapentacyclo[7.6.2.02,7.02,13.013,17]heptadec-7-en-6-yl)ethanon [German] [ACD/IUPAC Name]
1-(11,14-Dimethyl-6,14-diazapentacyclo[7.6.2.02,7.02,13.013,17]heptadec-7-en-6-yl)ethanone [ACD/IUPAC Name]
1-(11,14-Diméthyl-6,14-diazapentacyclo[7.6.2.02,7.02,13.013,17]heptadéc-7-én-6-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(2,3,5,6,9,10,11,12-octahydro-1,11-dimethyl-1H-3,9,12a-ethanylylidenepyrrolo[3',2':2,3]cycloocta[1,2-b]pyridin-7(4H)-yl)- [ACD/Index Name]
fastigiatine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 471.6±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 206.8±18.0 °C
Index of Refraction: 1.605
Molar Refractivity: 87.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.55
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 1.90
ACD/KOC (pH 7.4): 13.98
Polar Surface Area: 24 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 253.6±5.0 cm3

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