ChemSpider 2D Image | (2,5-Dichlorophenyl)(4-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)methanone | C20H20Cl2N6O2

(2,5-Dichlorophenyl)(4-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)methanone

  • Molecular FormulaC20H20Cl2N6O2
  • Average mass447.318 Da
  • Monoisotopic mass446.102478 Da
  • ChemSpider ID21931944

More details:

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

(2,5-Dichlorophenyl)(4-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)methanone [ACD/IUPAC Name]
(2,5-Dichlorophényl)(4-{[1-(4-méthoxyphényl)-1H-tétrazol-5-yl]méthyl}-1-pipérazinyl)méthanone [French] [ACD/IUPAC Name]
(2,5-Dichlorphenyl)(4-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]methyl}-1-piperazinyl)methanon [German] [ACD/IUPAC Name]
Methanone, (2,5-dichlorophenyl)[4-[[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]methyl]-1-piperazinyl]- [ACD/Index Name]
(2,5-dichlorophenyl)(4-((1-(4-methoxyphenyl)-1H-tetrazol-5-yl)methyl)piperazin-1-yl)methanone
(2,5-dichlorophenyl)-[4-[[1-(4-methoxyphenyl)tetrazol-5-yl]methyl]piperazin-1-yl]methanone
1-(2,5-dichlorobenzoyl)-4-{[1-(4-methoxyphenyl)-1H-1,2,3,4-tetrazol-5-yl]methyl}piperazine
1040678-37-2 [RN]
MFCD05990729

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

Density: 1.5±0.1 g/cm3
Boiling Point: 649.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.3±34.3 °C
Index of Refraction: 1.682
Molar Refractivity: 116.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 87.39
ACD/KOC (pH 5.5): 852.14
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 87.95
ACD/KOC (pH 7.4): 857.58
Polar Surface Area: 76 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 308.3±7.0 cm3

Click to predict properties on the Chemicalize site


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