ChemSpider 2D Image | 2-(3-Bromoadamantan-1-yl)-N-(3-methoxybenzyl)-N-methylacetamide | C21H28BrNO2

2-(3-Bromoadamantan-1-yl)-N-(3-methoxybenzyl)-N-methylacetamide

  • Molecular FormulaC21H28BrNO2
  • Average mass406.357 Da
  • Monoisotopic mass405.130341 Da
  • ChemSpider ID22363154

More details:

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

2-(3-Bromadamantan-1-yl)-N-(3-methoxybenzyl)-N-methylacetamid [German] [ACD/IUPAC Name]
2-(3-Bromoadamantan-1-yl)-N-(3-methoxybenzyl)-N-methylacetamide [ACD/IUPAC Name]
2-(3-Bromoadamantan-1-yl)-N-(3-méthoxybenzyl)-N-méthylacétamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-acetamide, 3-bromo-N-[(3-methoxyphenyl)methyl]-N-methyl- [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: 509.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 262.1±24.6 °C
Index of Refraction: 1.598
Molar Refractivity: 103.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 4.70
ACD/BCF (pH 5.5): 2184.13
ACD/KOC (pH 5.5): 8547.75
ACD/LogD (pH 7.4): 4.70
ACD/BCF (pH 7.4): 2184.13
ACD/KOC (pH 7.4): 8547.75
Polar Surface Area: 30 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 303.0±3.0 cm3

Click to predict properties on the Chemicalize site


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