ChemSpider 2D Image | 2-Methyl-2-propanyl 2-bromo-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate | C11H16BrN3O2

2-Methyl-2-propanyl 2-bromo-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate

  • Molecular FormulaC11H16BrN3O2
  • Average mass302.168 Da
  • Monoisotopic mass301.042572 Da
  • ChemSpider ID76622951

More details:

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

2-Bromo-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-bromo-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-brom-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-carboxylat [German] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-4(5H)-carboxylic acid, 2-bromo-6,7-dihydro-, 1,1-dimethylethyl ester [ACD/Index Name]
2167954-27-8 [RN]
tert-butyl 2-bromo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-4-carboxylate
tert-butyl 2-bromo-5H,6H,7H-pyrazolo[1,5-a]pyrimidine-4-carboxylate
tert-Butyl 2-bromo-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 395.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.5±3.0 kJ/mol
Flash Point: 192.9±24.6 °C
Index of Refraction: 1.612
Molar Refractivity: 68.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 71.52
ACD/KOC (pH 5.5): 739.60
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 71.52
ACD/KOC (pH 7.4): 739.61
Polar Surface Area: 47 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 198.1±7.0 cm3

Click to predict properties on the Chemicalize site


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