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Search term: QTPHSDHUHXUYFE-KIYNQFGBSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | (11R)-3-chloro-9-ethyl-6,7,10,11-tetrahydro-7,11-methanocycloocta[b]quinolin-12-amine | C18H19ClN2

(11R)-3-chloro-9-ethyl-6,7,10,11-tetrahydro-7,11-methanocycloocta[b]quinolin-12-amine

  • Molecular FormulaC18H19ClN2
  • Average mass298.810 Da
  • Monoisotopic mass298.123688 Da
  • ChemSpider ID23271383
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

(11R)-3-chloro-9-ethyl-6,7,10,11-tetrahydro-7,11-methanocycloocta[b]quinolin-12-amine
(1R)-7-Chlor-15-ethyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,5,7,9,14-hexaen-3-amin [German] [ACD/IUPAC Name]
(1R)-7-Chloro-15-ethyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,5,7,9,14-hexaen-3-amine [ACD/IUPAC Name]
(1R)-7-Chloro-15-éthyl-10-azatétracyclo[11.3.1.02,11.04,9]heptadéca-2(11),3,5,7,9,14-hexaén-3-amine [French] [ACD/IUPAC Name]
7,11-Methanocycloocta[b]quinolin-12-amine, 3-chloro-9-ethyl-6,7,10,11-tetrahydro-, (11R)- [ACD/Index Name]
huprine X

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

Density: 1.2±0.1 g/cm3
Boiling Point: 451.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 226.9±28.7 °C
Index of Refraction: 1.660
Molar Refractivity: 88.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 62.48
ACD/KOC (pH 5.5): 166.72
ACD/LogD (pH 7.4): 4.88
ACD/BCF (pH 7.4): 2160.95
ACD/KOC (pH 7.4): 5766.33
Polar Surface Area: 39 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

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