ChemSpider 2D Image | 2,2,2-Trifluoro-N-(2-sulfanylphenyl)acetamide | C8H6F3NOS

2,2,2-Trifluoro-N-(2-sulfanylphenyl)acetamide

  • Molecular FormulaC8H6F3NOS
  • Average mass221.199 Da
  • Monoisotopic mass221.012222 Da
  • ChemSpider ID28708228

More details:

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

2,2,2-Trifluor-N-(2-sulfanylphenyl)acetamid [German] [ACD/IUPAC Name]
2,2,2-Trifluoro-N-(2-sulfanylphenyl)acetamide [ACD/IUPAC Name]
2,2,2-Trifluoro-N-(2-sulfanylphényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2,2,2-trifluoro-N-(2-mercaptophenyl)- [ACD/Index Name]
91358-99-5 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 290.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 129.4±27.3 °C
Index of Refraction: 1.562
Molar Refractivity: 49.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.23
ACD/KOC (pH 5.5): 395.37
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 8.33
ACD/KOC (pH 7.4): 108.99
Polar Surface Area: 68 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 151.5±3.0 cm3

Click to predict properties on the Chemicalize site


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