ChemSpider 2D Image | 5-(4-Chloro-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorophenoxy)phenyl]-1,2,4-oxadiazole | C17H9Cl3N4O2

5-(4-Chloro-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorophenoxy)phenyl]-1,2,4-oxadiazole

  • Molecular FormulaC17H9Cl3N4O2
  • Average mass407.638 Da
  • Monoisotopic mass405.979095 Da
  • ChemSpider ID58868925

More details:

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

1,2,4-Oxadiazole, 5-(4-chloro-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorophenoxy)phenyl]- [ACD/Index Name]
5-(4-Chlor-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorphenoxy)phenyl]-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
5-(4-Chloro-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorophenoxy)phenyl]-1,2,4-oxadiazole [ACD/IUPAC Name]
5-(4-Chloro-1H-pyrazol-3-yl)-3-[4-(3,4-dichlorophénoxy)phényl]-1,2,4-oxadiazole [French] [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: 595.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 314.0±32.9 °C
Index of Refraction: 1.651
Molar Refractivity: 97.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.00
ACD/LogD (pH 5.5): 5.60
ACD/BCF (pH 5.5): 10685.15
ACD/KOC (pH 5.5): 26620.03
ACD/LogD (pH 7.4): 5.56
ACD/BCF (pH 7.4): 9580.33
ACD/KOC (pH 7.4): 23867.59
Polar Surface Area: 77 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 61.6±3.0 dyne/cm
Molar Volume: 267.2±3.0 cm3

Click to predict properties on the Chemicalize site


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