ChemSpider 2D Image | 2-(4-Chlorophenoxy)-1-(4-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)ethanone | C20H20Cl2N6O2

2-(4-Chlorophenoxy)-1-(4-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)ethanone

  • Molecular FormulaC20H20Cl2N6O2
  • Average mass447.318 Da
  • Monoisotopic mass446.102478 Da
  • ChemSpider ID22527096

More details:

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

2-(4-Chlorophenoxy)-1-(4-{[1-(4-chlorophenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)ethanone [ACD/IUPAC Name]
2-(4-Chlorophénoxy)-1-(4-{[1-(4-chlorophényl)-1H-tétrazol-5-yl]méthyl}-1-pipérazinyl)éthanone [French] [ACD/IUPAC Name]
2-(4-Chlorphenoxy)-1-(4-{[1-(4-chlorphenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-(4-chlorophenoxy)-1-[4-[[1-(4-chlorophenyl)-1H-tetrazol-5-yl]methyl]-1-piperazinyl]- [ACD/Index Name]
1049456-57-6 [RN]
2-(4-chlorophenoxy)-1-(4-((1-(4-chlorophenyl)-1H-tetrazol-5-yl)methyl)piperazin-1-yl)ethanone
2-(4-chlorophenoxy)-1-(4-{[1-(4-chlorophenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}piperazin-1-yl)ethan-1-one

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

Density: 1.4±0.1 g/cm3
Boiling Point: 654.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.4±3.0 kJ/mol
Flash Point: 349.4±34.3 °C
Index of Refraction: 1.681
Molar Refractivity: 117.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 128.43
ACD/KOC (pH 5.5): 1124.16
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 128.60
ACD/KOC (pH 7.4): 1125.68
Polar Surface Area: 76 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 57.5±7.0 dyne/cm
Molar Volume: 309.2±7.0 cm3

Click to predict properties on the Chemicalize site


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