ChemSpider 2D Image | 2-Hydroxy-5-[(trifluoromethyl)thio]benzaldehyde | C8H5F3O2S

2-Hydroxy-5-[(trifluoromethyl)thio]benzaldehyde

  • Molecular FormulaC8H5F3O2S
  • Average mass222.184 Da
  • Monoisotopic mass221.996231 Da
  • ChemSpider ID28710733

More details:

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

2-Hydroxy-5-[(trifluormethyl)sulfanyl]benzaldehyd [German] [ACD/IUPAC Name]
2-Hydroxy-5-[(trifluoromethyl)sulfanyl]benzaldehyde [ACD/IUPAC Name]
2-Hydroxy-5-[(trifluorométhyl)sulfanyl]benzaldéhyde [French] [ACD/IUPAC Name]
2-Hydroxy-5-[(trifluoromethyl)thio]benzaldehyde
93249-46-8 [RN]
Benzaldehyde, 2-hydroxy-5-[(trifluoromethyl)thio]- [ACD/Index Name]
2-Hydroxy-5-(trifluoromethylthio)benzaldehyde
MFCD22633622

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

Density: 1.5±0.1 g/cm3
Boiling Point: 194.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.8±3.0 kJ/mol
Flash Point: 71.4±27.3 °C
Index of Refraction: 1.542
Molar Refractivity: 46.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 122.58
ACD/KOC (pH 5.5): 1072.42
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 25.58
ACD/KOC (pH 7.4): 223.76
Polar Surface Area: 63 Å2
Polarizability: 18.3±0.5 10-24cm3
Surface Tension: 45.7±5.0 dyne/cm
Molar Volume: 147.0±5.0 cm3

Click to predict properties on the Chemicalize site


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