ChemSpider 2D Image | 4,6-Dibromo-1H-indole-3-acetonitrile | C10H6Br2N2

4,6-Dibromo-1H-indole-3-acetonitrile

  • Molecular FormulaC10H6Br2N2
  • Average mass313.976 Da
  • Monoisotopic mass311.889771 Da
  • ChemSpider ID24588179

More details:

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

(4,6-Dibrom-1H-indol-3-yl)acetonitril [German] [ACD/IUPAC Name]
(4,6-Dibromo-1H-indol-3-yl)acetonitrile [ACD/IUPAC Name]
(4,6-Dibromo-1H-indol-3-yl)acétonitrile [French] [ACD/IUPAC Name]
1227581-97-6 [RN]
1H-Indole-3-acetonitrile, 4,6-dibromo- [ACD/Index Name]
2-(4,6-Dibromo-1H-indol-3-yl)acetonitrile
4,6-Dibromo-1H-indole-3-acetonitrile
4,6-Dibromoindole-3-acetonitrile

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

Density: 2.0±0.1 g/cm3
Boiling Point: 471.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 239.0±27.3 °C
Index of Refraction: 1.720
Molar Refractivity: 63.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 318.25
ACD/KOC (pH 5.5): 2153.22
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 318.25
ACD/KOC (pH 7.4): 2153.22
Polar Surface Area: 40 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 160.4±3.0 cm3

Click to predict properties on the Chemicalize site


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