ChemSpider 2D Image | 4-{1-[1-(4-Chlorophenyl)-1H-1,2,3-triazol-4-yl]ethoxy}quinoline 1-oxide | C19H15ClN4O2

4-{1-[1-(4-Chlorophenyl)-1H-1,2,3-triazol-4-yl]ethoxy}quinoline 1-oxide

  • Molecular FormulaC19H15ClN4O2
  • Average mass366.801 Da
  • Monoisotopic mass366.088348 Da
  • ChemSpider ID24617851

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Oxyde de 4-{1-[1-(4-chlorophényl)-1H-1,2,3-triazol-4-yl]éthoxy}quinoléine [French] [ACD/IUPAC Name]
4-[(1r)-1-[1-(4-Chlorophenyl)-1,2,3-Triazol-4-Yl]ethoxy]-1-Oxidanyl-Quinoline
4-{1-[1-(4-Chlorophenyl)-1H-1,2,3-triazol-4-yl]ethoxy}quinoline 1-oxide [ACD/IUPAC Name]
4-{1-[1-(4-Chlorphenyl)-1H-1,2,3-triazol-4-yl]ethoxy}chinolin-1-oxid [German] [ACD/IUPAC Name]
Quinoline, 4-[1-[1-(4-chlorophenyl)-1H-1,2,3-triazol-4-yl]ethoxy]-, 1-oxide [ACD/Index Name]
1185388-35-5 [RN]
2YA
A110

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

Density: 1.4±0.1 g/cm3
Boiling Point: 588.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 309.4±32.9 °C
Index of Refraction: 1.676
Molar Refractivity: 100.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 45.89
ACD/KOC (pH 5.5): 538.30
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 45.92
ACD/KOC (pH 7.4): 538.61
Polar Surface Area: 65 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 267.5±7.0 cm3

Click to predict properties on the Chemicalize site


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