ChemSpider 2D Image | 3-(3-Buten-1-yl)-7-isobutyl-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonane | C21H40N2

3-(3-Buten-1-yl)-7-isobutyl-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonane

  • Molecular FormulaC21H40N2
  • Average mass320.556 Da
  • Monoisotopic mass320.319153 Da
  • ChemSpider ID23196616

More details:

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

3-(3-Buten-1-yl)-7-isobutyl-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonan [German] [ACD/IUPAC Name]
3-(3-Buten-1-yl)-7-isobutyl-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonane [ACD/IUPAC Name]
3-(3-Butén-1-yl)-7-isobutyl-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonane [French] [ACD/IUPAC Name]
3-(but-3-en-1-yl)-7-(2-methylpropyl)-9,9-dipropyl-3,7-diazabicyclo[3.3.1]nonane
3,7-Diazabicyclo[3.3.1]nonane, 3-(3-buten-1-yl)-7-(2-methylpropyl)-9,9-dipropyl- [ACD/Index Name]
3-But-3-enyl-7-isobutyl-9,9-dipropyl-3,7-diaza-bicyclo[3.3.1]nonane

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

Density: 0.9±0.1 g/cm3
Boiling Point: 387.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 166.7±15.7 °C
Index of Refraction: 1.470
Molar Refractivity: 102.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 7.17
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.41
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 21.18
ACD/KOC (pH 7.4): 53.24
Polar Surface Area: 6 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 28.3±3.0 dyne/cm
Molar Volume: 366.0±3.0 cm3

Click to predict properties on the Chemicalize site


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