ChemSpider 2D Image | tert-butyl 2-cyano-4,4-difluoropyrrolidine-1-carboxylate | C10H14F2N2O2

tert-butyl 2-cyano-4,4-difluoropyrrolidine-1-carboxylate

  • Molecular FormulaC10H14F2N2O2
  • Average mass232.227 Da
  • Monoisotopic mass232.102341 Da
  • ChemSpider ID60661400

More details:

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

1824348-84-6 [RN]
1-Pyrrolidinecarboxylic acid, 2-cyano-4,4-difluoro-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Cyano-4,4-difluoro-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-cyano-4,4-difluoro-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-cyan-4,4-difluor-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
tert-butyl 2-cyano-4,4-difluoropyrrolidine-1-carboxylate
MFCD24532444

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

Density: 1.2±0.1 g/cm3
Boiling Point: 311.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.2±3.0 kJ/mol
Flash Point: 142.2±27.9 °C
Index of Refraction: 1.460
Molar Refractivity: 52.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.50
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.70
ACD/KOC (pH 5.5): 88.79
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.70
ACD/KOC (pH 7.4): 88.79
Polar Surface Area: 53 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 37.1±5.0 dyne/cm
Molar Volume: 190.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement