ChemSpider 2D Image | 4-Cyclopropyl-3-fluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylic acid | C13H20FNO4

4-Cyclopropyl-3-fluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC13H20FNO4
  • Average mass273.301 Da
  • Monoisotopic mass273.137634 Da
  • ChemSpider ID77004366

More details:

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

1,3-Pyrrolidinedicarboxylic acid, 4-cyclopropyl-3-fluoro-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
4-Cyclopropyl-3-fluor-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
4-Cyclopropyl-3-fluoro-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
Acide 4-cyclopropyl-3-fluoro-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1-[(tert-butoxy)carbonyl]-4-cyclopropyl-3-fluoropyrrolidine-3-carboxylic acid
1-[(tert-butoxy)carbonyl]-4-cyclopropyl-3-fluoropyrrolidine-3-carboxylicacid
2377031-68-8 [RN]
MFCD32199879

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

Density: 1.3±0.1 g/cm3
Boiling Point: 375.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 68.4±6.0 kJ/mol
Flash Point: 180.9±27.9 °C
Index of Refraction: 1.516
Molar Refractivity: 65.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): -1.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 45.3±5.0 dyne/cm
Molar Volume: 217.2±5.0 cm3

Click to predict properties on the Chemicalize site


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