ChemSpider 2D Image | 3-Hydroxy-5-(trifluoromethyl)-2-thiophenecarbaldehyde | C6H3F3O2S

3-Hydroxy-5-(trifluoromethyl)-2-thiophenecarbaldehyde

  • Molecular FormulaC6H3F3O2S
  • Average mass196.147 Da
  • Monoisotopic mass195.980591 Da
  • ChemSpider ID60737402

More details:

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

2-Thiophenecarboxaldehyde, 3-hydroxy-5-(trifluoromethyl)- [ACD/Index Name]
3-Hydroxy-5-(trifluormethyl)-2-thiophencarbaldehyd [German] [ACD/IUPAC Name]
3-Hydroxy-5-(trifluoromethyl)-2-thiophenecarbaldehyde [ACD/IUPAC Name]
3-Hydroxy-5-(trifluorométhyl)-2-thiophènecarbaldéhyde [French] [ACD/IUPAC Name]
1378640-84-6 [RN]
MFCD18205213

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

Density: 1.6±0.1 g/cm3
Boiling Point: 220.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 86.8±25.9 °C
Index of Refraction: 1.537
Molar Refractivity: 38.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 78.80
ACD/KOC (pH 5.5): 783.73
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 19.24
ACD/KOC (pH 7.4): 191.36
Polar Surface Area: 66 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 122.5±3.0 cm3

Click to predict properties on the Chemicalize site


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