ChemSpider 2D Image | (1S,3R,7R,8S)-N-Methyl-2-oxa-6-azatricyclo[4.2.1.0~3,7~]nonan-8-amine | C8H14N2O

(1S,3R,7R,8S)-N-Methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine

  • Molecular FormulaC8H14N2O
  • Average mass154.210 Da
  • Monoisotopic mass154.110611 Da
  • ChemSpider ID22871094
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(1S,3R,7R,8S)-N-Methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amin [German] [ACD/IUPAC Name]
(1S,3R,7R,8S)-N-Methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine [ACD/IUPAC Name]
(1S,3R,7R,8S)-N-Méthyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine [French] [ACD/IUPAC Name]
2,4-Methano-4H-furo[3,2-b]pyrrol-3-amine, hexahydro-N-methyl-, (2S,3S,3aR,6aR)- [ACD/Index Name]
103616-00-8 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 232.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.9±3.0 kJ/mol
Flash Point: 94.5±25.9 °C
Index of Refraction: 1.573
Molar Refractivity: 42.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.63
ACD/LogD (pH 5.5): -3.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 25 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 43.7±5.0 dyne/cm
Molar Volume: 127.9±5.0 cm3

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