ChemSpider 2D Image | 2-(3,4,5-Tribromophenyl)propanenitrile | C9H6Br3N

2-(3,4,5-Tribromophenyl)propanenitrile

  • Molecular FormulaC9H6Br3N
  • Average mass367.863 Da
  • Monoisotopic mass364.805023 Da
  • ChemSpider ID61044282

More details:

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

2-(3,4,5-Tribromophenyl)propanenitrile [ACD/IUPAC Name]
2-(3,4,5-Tribromophényl)propanenitrile [French] [ACD/IUPAC Name]
2-(3,4,5-Tribromphenyl)propannitril [German] [ACD/IUPAC Name]
Benzeneacetonitrile, 3,4,5-tribromo-α-methyl- [ACD/Index Name]
1823790-71-1 [RN]
MFCD28021833

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

Density: 2.0±0.1 g/cm3
Boiling Point: 407.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.4±27.3 °C
Index of Refraction: 1.616
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1311.58
ACD/KOC (pH 5.5): 5933.59
ACD/LogD (pH 7.4): 4.41
ACD/BCF (pH 7.4): 1311.58
ACD/KOC (pH 7.4): 5933.59
Polar Surface Area: 24 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 181.4±3.0 cm3

Click to predict properties on the Chemicalize site


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