ChemSpider 2D Image | 1-(Adamantan-1-yl)-N-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methyl}ethanamine | C28H33ClN2

1-(Adamantan-1-yl)-N-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methyl}ethanamine

  • Molecular FormulaC28H33ClN2
  • Average mass433.028 Da
  • Monoisotopic mass432.233215 Da
  • ChemSpider ID78274967

More details:

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

1-(Adamantan-1-yl)-N-{[1-(4-chlorbenzyl)-1H-indol-3-yl]methyl}ethanamin [German] [ACD/IUPAC Name]
1-(Adamantan-1-yl)-N-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methyl}ethanamine [ACD/IUPAC Name]
1-(Adamantan-1-yl)-N-{[1-(4-chlorobenzyl)-1H-indol-3-yl]méthyl}éthanamine [French] [ACD/IUPAC Name]
1H-Indole-3-methanamine, 1-[(4-chlorophenyl)methyl]-N-(1-tricyclo[3.3.1.13,7]dec-1-ylethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 582.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±27.3 °C
Index of Refraction: 1.675
Molar Refractivity: 128.3±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.90
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 136.28
ACD/KOC (pH 5.5): 156.14
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 570.68
ACD/KOC (pH 7.4): 653.85
Polar Surface Area: 17 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 341.2±7.0 cm3

Click to predict properties on the Chemicalize site


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