ChemSpider 2D Image | Benzyl (3R)-1-benzyl-3-pyrrolidinecarboxylate | C19H21NO2

Benzyl (3R)-1-benzyl-3-pyrrolidinecarboxylate

  • Molecular FormulaC19H21NO2
  • Average mass295.375 Da
  • Monoisotopic mass295.157227 Da
  • ChemSpider ID32808585

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1-Benzyl-3-pyrrolidinecarboxylate de benzyle [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-(phenylmethyl)-, phenylmethyl ester, (3R)- [ACD/Index Name]
Benzyl (3R)-1-benzyl-3-pyrrolidinecarboxylate [ACD/IUPAC Name]
Benzyl-(3R)-1-benzyl-3-pyrrolidincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 403.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 135.0±18.2 °C
Index of Refraction: 1.591
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.91
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 43.87
ACD/KOC (pH 7.4): 277.88
Polar Surface Area: 30 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 256.4±3.0 cm3

Click to predict properties on the Chemicalize site


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