ChemSpider 2D Image | (R)-Boc-2-methylproline | C11H19NO4

(R)-Boc-2-methylproline

  • Molecular FormulaC11H19NO4
  • Average mass229.273 Da
  • Monoisotopic mass229.131409 Da
  • ChemSpider ID25070839

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-[(tert-Butoxy)carbonyl]-2-methylpyrrolidine-2-carboxylic acid
(R)-Boc-2-methylproline
(R)-N-Boc-α-Methylproline
1-(1,1-Dimethylethyl) (2R)-2-methyl-1,2-pyrrolidinedicarboxylic acid
1-(tert-butoxycarbonyl)-2-methyl-D-proline
1,2-Pyrrolidinedicarboxylic acid, 2-methyl-, 1-(1,1-dimethylethyl) ester, (2R)- [ACD/Index Name]
15016484 [Beilstein]
166170-15-6 [RN]
1-Boc-2-methyl-D-proline
1-tert-Butyl 2-methyl (2R)-pyrrolidine-1,2-dicarboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 337.8±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 63.9±6.0 kJ/mol
    Flash Point: 158.1±25.9 °C
    Index of Refraction: 1.494
    Molar Refractivity: 57.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.10
    ACD/LogD (pH 5.5): 0.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 8.03
    ACD/LogD (pH 7.4): -1.53
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 22.8±0.5 10-24cm3
    Surface Tension: 43.5±3.0 dyne/cm
    Molar Volume: 197.6±3.0 cm3

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