ChemSpider 2D Image | 5-(4-Bromo-1-methyl-1H-pyrazol-3-yl)-1,2,4-oxadiazole-3-carboxylic acid | C7H5BrN4O3

5-(4-Bromo-1-methyl-1H-pyrazol-3-yl)-1,2,4-oxadiazole-3-carboxylic acid

  • Molecular FormulaC7H5BrN4O3
  • Average mass273.044 Da
  • Monoisotopic mass271.954498 Da
  • ChemSpider ID65376832

More details:

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

1,2,4-Oxadiazole-3-carboxylic acid, 5-(4-bromo-1-methyl-1H-pyrazol-3-yl)- [ACD/Index Name]
5-(4-Brom-1-methyl-1H-pyrazol-3-yl)-1,2,4-oxadiazol-3-carbonsäure [German] [ACD/IUPAC Name]
5-(4-Bromo-1-methyl-1H-pyrazol-3-yl)-1,2,4-oxadiazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-(4-bromo-1-méthyl-1H-pyrazol-3-yl)-1,2,4-oxadiazole-3-carboxylique [French] [ACD/IUPAC Name]
2028376-08-9 [RN]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 506.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.7±3.0 kJ/mol
Flash Point: 260.0±32.9 °C
Index of Refraction: 1.789
Molar Refractivity: 53.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.10
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 78.5±7.0 dyne/cm
Molar Volume: 126.0±7.0 cm3

Click to predict properties on the Chemicalize site


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