ChemSpider 2D Image | (2R)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]quinolizin-2-yl]-3-buten-1-ol | C19H24N2O

(2R)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]quinolizin-2-yl]-3-buten-1-ol

  • Molecular FormulaC19H24N2O
  • Average mass296.407 Da
  • Monoisotopic mass296.188873 Da
  • ChemSpider ID60600405

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(2R)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]chinolizin-2-yl]-3-buten-1-ol [German] [ACD/IUPAC Name]
(2R)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]quinolizin-2-yl]-3-buten-1-ol [ACD/IUPAC Name]
(2R)-2-[(2S,12bS)-1,2,3,4,6,7,12,12b-Octahydroindolo[2,3-a]quinolizin-2-yl]-3-butén-1-ol [French] [ACD/IUPAC Name]
Indolo[2,3-a]quinolizine-2-ethanol, β-ethenyl-1,2,3,4,6,7,12,12b-octahydro-, (βR,2S,12bS)- [ACD/Index Name]
16049-28-8 [RN]
Antirhine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 488.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.4±3.0 kJ/mol
Flash Point: 249.1±27.3 °C
Index of Refraction: 1.652
Molar Refractivity: 90.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.13
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 1.94
ACD/KOC (pH 7.4): 16.73
Polar Surface Area: 39 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 246.6±5.0 cm3

Click to predict properties on the Chemicalize site


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