ChemSpider 2D Image | 1-(4-Bromophenyl)-N,N-diethyl-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxamide | C13H15BrN4O2

1-(4-Bromophenyl)-N,N-diethyl-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxamide

  • Molecular FormulaC13H15BrN4O2
  • Average mass339.188 Da
  • Monoisotopic mass338.037842 Da
  • ChemSpider ID21391369

More details:

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

1-(4-Bromophenyl)-N,N-diethyl-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxamide [ACD/IUPAC Name]
1-(4-Bromophényl)-N,N-diéthyl-5-oxo-2,5-dihydro-1H-1,2,4-triazole-3-carboxamide [French] [ACD/IUPAC Name]
1-(4-Bromophenyl)-N,N-diethyl-5-oxo-4,5-dihydro-1H-1,2,4-triazole-3-carboxamide
1-(4-Bromphenyl)-N,N-diethyl-5-oxo-2,5-dihydro-1H-1,2,4-triazol-3-carboxamid [German] [ACD/IUPAC Name]
1H-1,2,4-Triazole-3-carboxamide, 1-(4-bromophenyl)-N,N-diethyl-4,5-dihydro-5-oxo- [ACD/Index Name]
1-(4-Bromophenyl)-2,5-dihydro-5-oxo-1H-1,2,4-
1-(4-Bromophenyl)-2,5-dihydro-5-oxo-1H-1,2,4-triazole-3-carboxylic acid diethylamide
1000577-33-2 [RN]
MFCD09955021 [MDL number]
triazole-3-carboxylic acid diethylamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 80.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.21
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 2.47
ACD/KOC (pH 5.5): 47.18
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.38
Polar Surface Area: 65 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 221.3±7.0 cm3

Click to predict properties on the Chemicalize site


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