ChemSpider 2D Image | 4-(4-Bromo-2-chlorophenoxy)-3-methyl[1,2]oxazolo[5,4-d]pyrimidine | C12H7BrClN3O2

4-(4-Bromo-2-chlorophenoxy)-3-methyl[1,2]oxazolo[5,4-d]pyrimidine

  • Molecular FormulaC12H7BrClN3O2
  • Average mass340.560 Da
  • Monoisotopic mass338.941010 Da
  • ChemSpider ID127998916

More details:

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

4-(4-Brom-2-chlorphenoxy)-3-methyl[1,2]oxazolo[5,4-d]pyrimidin [German] [ACD/IUPAC Name]
4-(4-Bromo-2-chlorophenoxy)-3-methyl[1,2]oxazolo[5,4-d]pyrimidine [ACD/IUPAC Name]
4-(4-Bromo-2-chlorophénoxy)-3-méthyl[1,2]oxazolo[5,4-d]pyrimidine [French] [ACD/IUPAC Name]
Isoxazolo[5,4-d]pyrimidine, 4-(4-bromo-2-chlorophenoxy)-3-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: 428.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 213.1±28.7 °C
Index of Refraction: 1.664
Molar Refractivity: 74.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 163.51
ACD/KOC (pH 5.5): 1336.81
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 163.51
ACD/KOC (pH 7.4): 1336.81
Polar Surface Area: 61 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 61.4±3.0 dyne/cm
Molar Volume: 201.0±3.0 cm3

Click to predict properties on the Chemicalize site


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