ChemSpider 2D Image | (3s,5s,7s)-N-(3-Chlorophenyl)-1-adamantanecarboxamide | C17H20ClNO

(3s,5s,7s)-N-(3-Chlorophenyl)-1-adamantanecarboxamide

  • Molecular FormulaC17H20ClNO
  • Average mass289.800 Da
  • Monoisotopic mass289.123352 Da
  • ChemSpider ID62329595

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3s,5s,7s)-N-(3-Chlorophenyl)-1-adamantanecarboxamide [ACD/IUPAC Name]
(3s,5s,7s)-N-(3-Chlorophényl)-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
(3s,5s,7s)-N-(3-Chlorphenyl)-1-adamantancarboxamid [German] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, N-(3-chlorophenyl)- [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: 462.4±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.3±3.0 kJ/mol
Flash Point: 233.5±24.0 °C
Index of Refraction: 1.638
Molar Refractivity: 80.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 4.70
ACD/BCF (pH 5.5): 2180.85
ACD/KOC (pH 5.5): 8538.57
ACD/LogD (pH 7.4): 4.70
ACD/BCF (pH 7.4): 2180.86
ACD/KOC (pH 7.4): 8538.59
Polar Surface Area: 29 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 224.7±3.0 cm3

Click to predict properties on the Chemicalize site


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