ChemSpider 2D Image | 3-Methyl-1-(4,4,4-trifluorobutanoyl)-3-pyrrolidinecarboxylic acid | C10H14F3NO3

3-Methyl-1-(4,4,4-trifluorobutanoyl)-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC10H14F3NO3
  • Average mass253.218 Da
  • Monoisotopic mass253.092575 Da
  • ChemSpider ID49028649

More details:

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

3-Methyl-1-(4,4,4-trifluorbutanoyl)-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
3-Methyl-1-(4,4,4-trifluorobutanoyl)-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 3-methyl-1-(4,4,4-trifluoro-1-oxobutyl)- [ACD/Index Name]
Acide 3-méthyl-1-(4,4,4-trifluorobutanoyl)-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1483969-97-6 [RN]
MFCD21051227

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

Density: 1.3±0.1 g/cm3
Boiling Point: 356.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 66.2±6.0 kJ/mol
Flash Point: 169.6±27.9 °C
Index of Refraction: 1.453
Molar Refractivity: 51.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.51
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 38.1±3.0 dyne/cm
Molar Volume: 191.1±3.0 cm3

Click to predict properties on the Chemicalize site


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