ChemSpider 2D Image | {4-[(Trimethylsilyl)ethynyl]phenyl}methanethiol | C12H16SSi

{4-[(Trimethylsilyl)ethynyl]phenyl}methanethiol

  • Molecular FormulaC12H16SSi
  • Average mass220.406 Da
  • Monoisotopic mass220.074203 Da
  • ChemSpider ID86563289

More details:

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

{4-[(Trimethylsilyl)ethinyl]phenyl}methanthiol [German] [ACD/IUPAC Name]
{4-[(Trimethylsilyl)ethynyl]phenyl}methanethiol [ACD/IUPAC Name]
{4-[(Triméthylsilyl)éthynyl]phényl}méthanethiol [French] [ACD/IUPAC Name]
Benzenemethanethiol, 4-[2-(trimethylsilyl)ethynyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 279.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 49.8±3.0 kJ/mol
Flash Point: 123.0±25.1 °C
Index of Refraction: 1.537
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2238.75
ACD/KOC (pH 5.5): 8700.10
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2229.64
ACD/KOC (pH 7.4): 8664.67
Polar Surface Area: 39 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 33.4±5.0 dyne/cm
Molar Volume: 221.6±5.0 cm3

Click to predict properties on the Chemicalize site


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