ChemSpider 2D Image | 2-(3,5-Dibromo-1H-pyrazol-4-yl)-1-propanamine | C6H9Br2N3

2-(3,5-Dibromo-1H-pyrazol-4-yl)-1-propanamine

  • Molecular FormulaC6H9Br2N3
  • Average mass282.964 Da
  • Monoisotopic mass280.916321 Da
  • ChemSpider ID97359513

More details:

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

1H-Pyrazole-4-ethanamine, 3,5-dibromo-β-methyl- [ACD/Index Name]
2-(3,5-Dibrom-1H-pyrazol-4-yl)-1-propanamin [German] [ACD/IUPAC Name]
2-(3,5-Dibromo-1H-pyrazol-4-yl)-1-propanamine [ACD/IUPAC Name]
2-(3,5-Dibromo-1H-pyrazol-4-yl)-1-propanamine [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 390.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 189.8±26.5 °C
Index of Refraction: 1.623
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.37
Polar Surface Area: 55 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 147.1±3.0 cm3

Click to predict properties on the Chemicalize site


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