ChemSpider 2D Image | 4-(4-Chlorophenyl)-2-(~2~H_5_)phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile | C19H12D5ClN4

4-(4-Chlorophenyl)-2-(2H5)phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile

  • Molecular FormulaC19H12D5ClN4
  • Average mass341.849 Da
  • Monoisotopic mass341.145569 Da
  • ChemSpider ID28295657

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-1,2,4-Triazole-1-propanenitrile, α-[2-(4-chlorophenyl)ethyl]-α-(phenyl-d5)- [ACD/Index Name]
4-(4-Chlorophenyl)-2-(2H5)phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile [ACD/IUPAC Name]
4-(4-Chlorophényl)-2-(2H5)phényl-2-(1H-1,2,4-triazol-1-ylméthyl)butanenitrile [French] [ACD/IUPAC Name]
4-(4-Chlorphenyl)-2-(2H5)phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butannitril [German] [ACD/IUPAC Name]
(?)-4-(4-Chlorophenyl)-2-phenyl-2-[(1H-1,2,4-triazol-1-yl)methyl]butyronitrile
(?)-Fenbuconazole-d5 (phenyl-d5)
1398066-06-2 [RN]
4-(4-chlorophenyl)-2-(2,3,4,5,6-pentadeuteriophenyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile
Fenbuconazole (phenyl D5) 100 ng/?l in Acetone
Fenbuconazole (phenyl D5) 100 ng/µl in Acetone
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 546.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 284.2±32.9 °C
Index of Refraction: 1.617
Molar Refractivity: 99.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 362.35
ACD/KOC (pH 5.5): 2362.18
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 362.67
ACD/KOC (pH 7.4): 2364.27
Polar Surface Area: 55 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 47.8±7.0 dyne/cm
Molar Volume: 284.6±7.0 cm3

Click to predict properties on the Chemicalize site


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