ChemSpider 2D Image | Methyl (2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenyl)acetate | C18H15BrN2O4

Methyl (2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenyl)acetate

  • Molecular FormulaC18H15BrN2O4
  • Average mass403.227 Da
  • Monoisotopic mass402.021515 Da
  • ChemSpider ID21126300

More details:

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

(2-{[3-(4-Bromophényl)-1,2,4-oxadiazol-5-yl]méthoxy}phényl)acétate de méthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methoxy]-, methyl ester [ACD/Index Name]
Methyl (2-{[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenyl)acetate [ACD/IUPAC Name]
Methyl-(2-{[3-(4-bromphenyl)-1,2,4-oxadiazol-5-yl]methoxy}phenyl)acetat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 518.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 267.3±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 94.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 426.65
ACD/KOC (pH 5.5): 2655.88
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 426.65
ACD/KOC (pH 7.4): 2655.88
Polar Surface Area: 74 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 277.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement