ChemSpider 2D Image | (3R)-1-Benzyl-3-(methoxycarbonyl)pyrrolidinium | C13H18NO2

(3R)-1-Benzyl-3-(methoxycarbonyl)pyrrolidinium

  • Molecular FormulaC13H18NO2
  • Average mass220.287 Da
  • Monoisotopic mass220.133209 Da
  • ChemSpider ID95600909

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1-Benzyl-3-(methoxycarbonyl)pyrrolidinium [German] [ACD/IUPAC Name]
(3R)-1-Benzyl-3-(methoxycarbonyl)pyrrolidinium [ACD/IUPAC Name]
(3R)-1-Benzyl-3-(méthoxycarbonyl)pyrrolidinium [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-(phenylmethyl)-, methyl ester, conjugate acid, (3R)- [ACD/Index Name]

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

Density:
Boiling Point: 292.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.2±3.0 kJ/mol
Flash Point: 104.8±16.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 1.86
ACD/KOC (pH 7.4): 28.47
Polar Surface Area: 31 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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