ChemSpider 2D Image | 2,3-Dibromopropanenitrile | C3H3Br2N

2,3-Dibromopropanenitrile

  • Molecular FormulaC3H3Br2N
  • Average mass212.871 Da
  • Monoisotopic mass210.863205 Da
  • ChemSpider ID21427445

More details:

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

2,3-Dibromopropanenitrile [ACD/IUPAC Name]
2,3-Dibromopropanenitrile [French] [ACD/IUPAC Name]
2,3-Dibrompropannitril [German] [ACD/IUPAC Name]
Propanenitrile, 2,3-dibromo- [ACD/Index Name]
4554-16-9 [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: 173.0±0.0 °C at 760 mmHg
Vapour Pressure: 1.3±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.9±3.0 kJ/mol
Flash Point: 81.1±23.2 °C
Index of Refraction: 1.550
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.87
ACD/KOC (pH 5.5): 285.02
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.87
ACD/KOC (pH 7.4): 285.02
Polar Surface Area: 24 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 98.2±3.0 cm3

Click to predict properties on the Chemicalize site


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