ChemSpider 2D Image | (3s,5s,7s)-1-(~2~H_15_)Adamantanecarboxamide | C11H2D15NO

(3s,5s,7s)-1-(2H15)Adamantanecarboxamide

  • Molecular FormulaC11H2D15NO
  • Average mass194.351 Da
  • Monoisotopic mass194.225159 Da
  • ChemSpider ID107441718

  • defined stereocentres - 3 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3s,5s,7s)-1-(2H15)Adamantancarboxamid [German] [ACD/IUPAC Name]
(3s,5s,7s)-1-(2H15)Adamantanecarboxamide [ACD/IUPAC Name]
(3s,5s,7s)-1-(2H15)Adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-d15-1-carboxamide [ACD/Index 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: 343.3±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.7±3.0 kJ/mol
Flash Point: 161.4±18.7 °C
Index of Refraction: 1.572
Molar Refractivity: 50.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.65
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.05
ACD/KOC (pH 5.5): 297.61
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.05
ACD/KOC (pH 7.4): 297.61
Polar Surface Area: 43 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 152.6±3.0 cm3

Click to predict properties on the Chemicalize site


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