ChemSpider 2D Image | 2-(4-Bromophenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3,4-oxadiazole | C18H17BrN2O

2-(4-Bromophenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3,4-oxadiazole

  • Molecular FormulaC18H17BrN2O
  • Average mass357.244 Da
  • Monoisotopic mass356.052429 Da
  • ChemSpider ID21143223

More details:

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

1,3,4-Oxadiazole, 2-(4-bromophenyl)-5-[4-(1,1-dimethylethyl)phenyl]- [ACD/Index Name]
2-(4-Bromophenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3,4-oxadiazole [ACD/IUPAC Name]
2-(4-Bromophényl)-5-[4-(2-méthyl-2-propanyl)phényl]-1,3,4-oxadiazole [French] [ACD/IUPAC Name]
2-(4-Bromphenyl)-5-[4-(2-methyl-2-propanyl)phenyl]-1,3,4-oxadiazol [German] [ACD/IUPAC Name]
2-(4-Bromophenyl)-5-(4-(tert-butyl)phenyl)-1,3,4-oxadiazole
2-(4-bromophenyl)-5-(4-tert-butylphenyl)-[1,3,4]oxadiazole
2-(4-Bromo-phenyl)-5-(4-tert-butyl-phenyl)-[1,3,4]oxadiazole
2-(4-bromophenyl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole
220843-12-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 444.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 222.6±31.5 °C
Index of Refraction: 1.576
Molar Refractivity: 90.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.78
ACD/LogD (pH 5.5): 5.61
ACD/BCF (pH 5.5): 10872.28
ACD/KOC (pH 5.5): 26964.20
ACD/LogD (pH 7.4): 5.61
ACD/BCF (pH 7.4): 10872.28
ACD/KOC (pH 7.4): 26964.20
Polar Surface Area: 39 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 272.1±3.0 cm3

Click to predict properties on the Chemicalize site


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