ChemSpider 2D Image | (2R)-N-Methyl-1-[(5R,7S)-2-phenyladamantan-1-yl]-2-propanamine | C20H29N

(2R)-N-Methyl-1-[(5R,7S)-2-phenyladamantan-1-yl]-2-propanamine

  • Molecular FormulaC20H29N
  • Average mass283.451 Da
  • Monoisotopic mass283.230011 Da
  • ChemSpider ID32801489

  • defined stereocentres - 3 of 6 defined stereocentres

More details:

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

(2R)-N-Methyl-1-[(5R,7S)-2-phenyladamantan-1-yl]-2-propanamin [German] [ACD/IUPAC Name]
(2R)-N-Methyl-1-[(5R,7S)-2-phenyladamantan-1-yl]-2-propanamine [ACD/IUPAC Name]
(2R)-N-Méthyl-1-[(5R,7S)-2-phényladamantan-1-yl]-2-propanamine [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-ethanamine, N,α-dimethyl-2-phenyl-, (αR,5R,7S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 385.7±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 169.4±11.4 °C
Index of Refraction: 1.551
Molar Refractivity: 88.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 3.60
ACD/KOC (pH 5.5): 11.48
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 5.79
ACD/KOC (pH 7.4): 18.44
Polar Surface Area: 12 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 278.2±3.0 cm3

Click to predict properties on the Chemicalize site


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