ChemSpider 2D Image | 4-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazole | C20H17BrN4OS

4-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazole

  • Molecular FormulaC20H17BrN4OS
  • Average mass441.344 Da
  • Monoisotopic mass440.030640 Da
  • ChemSpider ID26021634

More details:

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

4-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazole [ACD/IUPAC Name]
4-[4-(4-Bromophényl)-1,3-thiazol-2-yl]-1-(4-éthoxyphényl)-5-méthyl-1H-1,2,3-triazole [French] [ACD/IUPAC Name]
4-[4-(4-Bromphenyl)-1,3-thiazol-2-yl]-1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol [German] [ACD/IUPAC Name]
Thiazole, 4-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]- [ACD/Index Name]
1206986-21-1 [RN]
4-(4-bromophenyl)-2-(1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl)thiazole
4-(4-bromophenyl)-2-[1-(4-ethoxyphenyl)-5-methyltriazol-4-yl]-1,3-thiazole
4-[4-(4-Bromo-phenyl)-thiazol-2-yl]-1-(4-ethoxy-phenyl)-5-methyl-1H-[1,2,3]triazole
MFCD16636930

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

Density: 1.5±0.1 g/cm3
Boiling Point: 621.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.7±34.3 °C
Index of Refraction: 1.694
Molar Refractivity: 114.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 5.29
ACD/BCF (pH 5.5): 6154.32
ACD/KOC (pH 5.5): 17942.67
ACD/LogD (pH 7.4): 5.29
ACD/BCF (pH 7.4): 6154.33
ACD/KOC (pH 7.4): 17942.67
Polar Surface Area: 81 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 297.1±7.0 cm3

Click to predict properties on the Chemicalize site


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