ChemSpider 2D Image | 1-[2-(3,4-Dichlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanone | C19H18Cl2N2O5

1-[2-(3,4-Dichlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanone

  • Molecular FormulaC19H18Cl2N2O5
  • Average mass425.263 Da
  • Monoisotopic mass424.059265 Da
  • ChemSpider ID23276092

More details:

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

1-[2-(3,4-Dichlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanone [ACD/IUPAC Name]
1-[2-(3,4-Dichlorophényl)-5-(3,4,5-triméthoxyphényl)-1,3,4-oxadiazol-3(2H)-yl]éthanone [French] [ACD/IUPAC Name]
1-[2-(3,4-Dichlorphenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-[2-(3,4-dichlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl]- [ACD/Index Name]
1-(2-(3,4-dichlorophenyl)-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-3(2H)-yl)ethanone
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL384183/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 520.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.5±32.9 °C
Index of Refraction: 1.596
Molar Refractivity: 104.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 145.74
ACD/KOC (pH 5.5): 1231.12
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 145.74
ACD/KOC (pH 7.4): 1231.12
Polar Surface Area: 70 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 43.5±7.0 dyne/cm
Molar Volume: 306.7±7.0 cm3

Click to predict properties on the Chemicalize site


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