ChemSpider 2D Image | N-{[1-(3-Chlorobenzyl)-1H-indol-3-yl]methyl}-3,5-dimethyl-1-adamantanamine | C28H33ClN2

N-{[1-(3-Chlorobenzyl)-1H-indol-3-yl]methyl}-3,5-dimethyl-1-adamantanamine

  • Molecular FormulaC28H33ClN2
  • Average mass433.028 Da
  • Monoisotopic mass432.233215 Da
  • ChemSpider ID78083013

More details:

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

1H-Indole-3-methanamine, 1-[(3-chlorophenyl)methyl]-N-(3,5-dimethyltricyclo[3.3.1.13,7]dec-1-yl)- [ACD/Index Name]
N-{[1-(3-Chlorbenzyl)-1H-indol-3-yl]methyl}-3,5-dimethyl-1-adamantanamin [German] [ACD/IUPAC Name]
N-{[1-(3-Chlorobenzyl)-1H-indol-3-yl]methyl}-3,5-dimethyl-1-adamantanamine [ACD/IUPAC Name]
N-{[1-(3-Chlorobenzyl)-1H-indol-3-yl]méthyl}-3,5-diméthyl-1-adamantanamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 569.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.0±27.3 °C
Index of Refraction: 1.657
Molar Refractivity: 129.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.98
ACD/LogD (pH 5.5): 4.10
ACD/BCF (pH 5.5): 139.98
ACD/KOC (pH 5.5): 157.60
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 216.24
ACD/KOC (pH 7.4): 243.47
Polar Surface Area: 17 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 351.1±7.0 cm3

Click to predict properties on the Chemicalize site


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