ChemSpider 2D Image | 2-Methyl-2-propanyl (2R)-2-(3-bromophenyl)-1-pyrrolidinecarboxylate | C15H20BrNO2

2-Methyl-2-propanyl (2R)-2-(3-bromophenyl)-1-pyrrolidinecarboxylate

  • Molecular FormulaC15H20BrNO2
  • Average mass326.229 Da
  • Monoisotopic mass325.067749 Da
  • ChemSpider ID32793897

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-(3-Bromophényl)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarboxylic acid, 2-(3-bromophenyl)-, 1,1-dimethylethyl ester, (2R)- [ACD/Index Name]
2-Methyl-2-propanyl (2R)-2-(3-bromophenyl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2R)-2-(3-bromphenyl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
2500579-89-3 [RN]
tert-butyl (2R)-2-(3-bromophenyl)pyrrolidine-1-carboxylate
tert-Butyl (R)-2-(3-bromophenyl)pyrrolidine-1-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 382.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 184.9±27.9 °C
Index of Refraction: 1.551
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 739.84
ACD/KOC (pH 5.5): 3938.50
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 739.84
ACD/KOC (pH 7.4): 3938.50
Polar Surface Area: 30 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 247.3±3.0 cm3

Click to predict properties on the Chemicalize site


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