ChemSpider 2D Image | 2-((Trimethylsilyl)ethynyl)benzonitrile | C12H13NSi

2-((Trimethylsilyl)ethynyl)benzonitrile

  • Molecular FormulaC12H13NSi
  • Average mass199.324 Da
  • Monoisotopic mass199.081726 Da
  • ChemSpider ID21472614

More details:

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

1-(2-Cyanophenyl)-2-(trimethylsilyl)acetylene
2-((Trimethylsilyl)ethynyl)benzonitrile
2-[(Trimethylsilanyl)ethynyl]benzonitrile
2-[(Trimethylsilyl)ethinyl]benzonitril [German] [ACD/IUPAC Name]
2-[(Trimethylsilyl)ethynyl]benzonitrile [ACD/IUPAC Name]
2-[(Triméthylsilyl)éthynyl]benzonitrile [French] [ACD/IUPAC Name]
97308-62-8 [RN]
Benzonitrile, 2-[2-(trimethylsilyl)ethynyl]- [ACD/Index Name]
MFCD09260485 [MDL number]
[(2-Cyanophenyl)ethynyl]trimethylsilane
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.0±0.1 g/cm3
Boiling Point: 276.5±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.5±3.0 kJ/mol
Flash Point: 121.0±25.1 °C
Index of Refraction: 1.521
Molar Refractivity: 61.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 701.89
ACD/KOC (pH 5.5): 3792.81
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 701.89
ACD/KOC (pH 7.4): 3792.81
Polar Surface Area: 24 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 35.0±5.0 dyne/cm
Molar Volume: 201.0±5.0 cm3

Click to predict properties on the Chemicalize site


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