ChemSpider 2D Image | [3-Hydroxy-3-(trifluoromethyl)-1-pyrrolidinyl](5-methyl-2-thienyl)methanone | C11H12F3NO2S

[3-Hydroxy-3-(trifluoromethyl)-1-pyrrolidinyl](5-methyl-2-thienyl)methanone

  • Molecular FormulaC11H12F3NO2S
  • Average mass279.279 Da
  • Monoisotopic mass279.054077 Da
  • ChemSpider ID30468923

More details:

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

[3-Hydroxy-3-(trifluormethyl)-1-pyrrolidinyl](5-methyl-2-thienyl)methanon [German] [ACD/IUPAC Name]
[3-Hydroxy-3-(trifluoromethyl)-1-pyrrolidinyl](5-methyl-2-thienyl)methanone [ACD/IUPAC Name]
[3-Hydroxy-3-(trifluorométhyl)-1-pyrrolidinyl](5-méthyl-2-thiényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-hydroxy-3-(trifluoromethyl)-1-pyrrolidinyl](5-methyl-2-thienyl)- [ACD/Index Name]
1-(5-METHYLTHIOPHENE-2-CARBONYL)-3-(TRIFLUOROMETHYL)PYRROLIDIN-3-OL
1385267-41-3 [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: 381.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 184.4±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 61.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.79
ACD/KOC (pH 5.5): 203.54
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.79
ACD/KOC (pH 7.4): 203.54
Polar Surface Area: 69 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 191.0±3.0 cm3

Click to predict properties on the Chemicalize site


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