ChemSpider 2D Image | (4R)-4-Acetyl-4-methyl-D-proline | C8H13NO3

(4R)-4-Acetyl-4-methyl-D-proline

  • Molecular FormulaC8H13NO3
  • Average mass171.194 Da
  • Monoisotopic mass171.089539 Da
  • ChemSpider ID32797155

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-4-Acetyl-4-methyl-D-prolin [German] [ACD/IUPAC Name]
(4R)-4-Acetyl-4-methyl-D-proline [ACD/IUPAC Name]
(4R)-4-Acétyl-4-méthyl-D-proline [French] [ACD/IUPAC Name]
D-Proline, 4-acetyl-4-methyl-, (4R)- [ACD/Index Name]
(2R,4R)-4-acetyl-4-methylpyrrolidine-2-carboxylic acid
1923268-58-9 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 318.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 61.6±6.0 kJ/mol
    Flash Point: 146.6±27.9 °C
    Index of Refraction: 1.481
    Molar Refractivity: 41.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.44
    ACD/LogD (pH 5.5): -2.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.61
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 66 Å2
    Polarizability: 16.5±0.5 10-24cm3
    Surface Tension: 40.8±3.0 dyne/cm
    Molar Volume: 146.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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