ChemSpider 2D Image | 2-[(2,4,5-Trichlorophenoxy)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole | C18H15Cl3N2O5

2-[(2,4,5-Trichlorophenoxy)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole

  • Molecular FormulaC18H15Cl3N2O5
  • Average mass445.681 Da
  • Monoisotopic mass444.004669 Da
  • ChemSpider ID33996372

More details:

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

1,3,4-Oxadiazole, 2-[(2,4,5-trichlorophenoxy)methyl]-5-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]
2-[(2,4,5-Trichlorophenoxy)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole [ACD/IUPAC Name]
2-[(2,4,5-Trichlorophénoxy)méthyl]-5-(3,4,5-triméthoxyphényl)-1,3,4-oxadiazole [French] [ACD/IUPAC Name]
2-[(2,4,5-Trichlorphenoxy)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 578.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 303.6±32.9 °C
Index of Refraction: 1.579
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1500.59
ACD/KOC (pH 5.5): 6533.82
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 1500.59
ACD/KOC (pH 7.4): 6533.82
Polar Surface Area: 76 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 316.5±3.0 cm3

Click to predict properties on the Chemicalize site


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