ChemSpider 2D Image | 2-(4-chlorophenyl)-1,3-dicyano-6,7-dihydro-4-imino-9,10-dimethoxybenzo(a)quinolizine | C23H17ClN4O2

2-(4-chlorophenyl)-1,3-dicyano-6,7-dihydro-4-imino-9,10-dimethoxybenzo(a)quinolizine

  • Molecular FormulaC23H17ClN4O2
  • Average mass416.860 Da
  • Monoisotopic mass416.104004 Da
  • ChemSpider ID21134956

More details:

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

2-(4-chlorophenyl)-1,3-dicyano-6,7-dihydro-4-imino-9,10-dimethoxybenzo(a)quinolizine
2-(4-Chlorophényl)-4-imino-9,10-diméthoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoléine-1,3-dicarbonitrile [French] [ACD/IUPAC Name]
2-(4-Chlorophenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isoquinoline-1,3-dicarbonitrile [ACD/IUPAC Name]
2-(4-Chlorphenyl)-4-imino-9,10-dimethoxy-6,7-dihydro-4H-pyrido[2,1-a]isochinolin-1,3-dicarbonitril [German] [ACD/IUPAC Name]
4H-Benzo[a]quinolizine-1,3-dicarbonitrile, 2-(4-chlorophenyl)-6,7-dihydro-4-imino-9,10-dimethoxy- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 548.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 285.5±32.9 °C
Index of Refraction: 1.664
Molar Refractivity: 115.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 674.27
ACD/KOC (pH 5.5): 3045.21
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1303.59
ACD/KOC (pH 7.4): 5887.42
Polar Surface Area: 93 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 310.2±7.0 cm3

Click to predict properties on the Chemicalize site


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