ChemSpider 2D Image | Huprine W | C18H19ClN2O

Huprine W

  • Molecular FormulaC18H19ClN2O
  • Average mass314.809 Da
  • Monoisotopic mass314.118591 Da
  • ChemSpider ID35033842
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

2-[(1S,13S)-3-Amino-7-chlor-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,5,7,9,14-hexaen-15-yl]ethanol [German] [ACD/IUPAC Name]
2-[(1S,13S)-3-Amino-7-chloro-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,5,7,9,14-hexaen-15-yl]ethanol [ACD/IUPAC Name]
2-[(1S,13S)-3-Amino-7-chloro-10-azatétracyclo[11.3.1.02,11.04,9]heptadéca-2(11),3,5,7,9,14-hexaén-15-yl]éthanol [French] [ACD/IUPAC Name]
7,11-Methanocycloocta[b]quinoline-9-ethanol, 12-amino-3-chloro-6,7,10,11-tetrahydro-, (7S,11S)- [ACD/Index Name]
Huprine W
HUW

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

Density: 1.3±0.1 g/cm3
Boiling Point: 501.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 257.2±30.1 °C
Index of Refraction: 1.683
Molar Refractivity: 90.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 6.27
ACD/KOC (pH 5.5): 32.85
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 220.70
ACD/KOC (pH 7.4): 1155.97
Polar Surface Area: 59 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 238.4±3.0 cm3

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