Found 231 results

Search term: MF = 'C_{13}H_{9}BrN_{4}O_{3}'
ChemSpider 2D Image | 5-(3-Bromophenyl)-2-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,3-oxazole | C13H9BrN4O3

5-(3-Bromophenyl)-2-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,3-oxazole

  • Molecular FormulaC13H9BrN4O3
  • Average mass349.140 Da
  • Monoisotopic mass347.985809 Da
  • ChemSpider ID30466888

More details:

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

5-(3-Bromophenyl)-2-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,3-oxazole [ACD/IUPAC Name]
5-(3-Bromophényl)-2-[(4-nitro-1H-pyrazol-1-yl)méthyl]-1,3-oxazole [French] [ACD/IUPAC Name]
5-(3-Bromphenyl)-2-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,3-oxazol [German] [ACD/IUPAC Name]
Oxazole, 5-(3-bromophenyl)-2-[(4-nitro-1H-pyrazol-1-yl)methyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 508.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 261.6±27.3 °C
Index of Refraction: 1.721
Molar Refractivity: 79.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 83.07
ACD/KOC (pH 5.5): 823.32
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 83.07
ACD/KOC (pH 7.4): 823.32
Polar Surface Area: 90 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 66.3±7.0 dyne/cm
Molar Volume: 201.0±7.0 cm3

Click to predict properties on the Chemicalize site


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