ChemSpider 2D Image | Benzyl (3R)-3-pyrrolidinylcarbamate | C12H16N2O2

Benzyl (3R)-3-pyrrolidinylcarbamate

  • Molecular FormulaC12H16N2O2
  • Average mass220.268 Da
  • Monoisotopic mass220.121185 Da
  • ChemSpider ID21107727
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Pyrrolidinylcarbamate de benzyle [French] [ACD/IUPAC Name]
Benzyl (3R)-3-pyrrolidinylcarbamate [ACD/IUPAC Name]
Benzyl (3R)-pyrrolidin-3-ylcarbamate
Benzyl-(3R)-3-pyrrolidinylcarbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(3R)-3-pyrrolidinyl]-, phenylmethyl ester [ACD/Index Name]
(R)-3-N-CBZ-amino Pyrrolidine
(R)-benzyl pyrrolidin-3-ylcarbamate

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

  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-16127]
    • Safety:

      20/21/22 Novochemy [NC-16127]
      20/21/36/37/39 Novochemy [NC-16127]
      GHS07; GHS09 Novochemy [NC-16127]
      H304; H403 Novochemy [NC-16127]
      P309+P311; P211; P242 Novochemy [NC-16127]
      R22 Novochemy [NC-16127]
      Warning Novochemy [NC-16127]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 382.5±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 185.1±27.6 °C
Index of Refraction: 1.565
Molar Refractivity: 61.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -1.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.29
Polar Surface Area: 50 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 46.5±5.0 dyne/cm
Molar Volume: 189.3±5.0 cm3

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