ChemSpider 2D Image | ABL127 | C17H20N2O5

ABL127

  • Molecular FormulaC17H20N2O5
  • Average mass332.351 Da
  • Monoisotopic mass332.137207 Da
  • ChemSpider ID26361087

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1,2-Dicarboxylic acid, 3-cyclopentyl-4-oxo-3-phenyl-1,2-diazetidine 1,2-dimethyl ester
(3R)-3-Cyclopentyl-4-oxo-3-phényl-1,2-diazétidine-1,2-dicarboxylate de diméthyle [French] [ACD/IUPAC Name]
(3R)-Dimethyl 3-cyclopentyl-4-oxo-3-phenyl-1,2-diazetidine-1,2-dicarboxylate
1,2-Diazetidine-1,2-dicarboxylic acid, 3-cyclopentyl-4-oxo-3-phenyl-, dimethyl ester, (3R)- [ACD/Index Name]
1073529-41-5 [RN]
ABL 127
ABL127
CID24856225
Dimethyl (3R)-3-cyclopentyl-4-oxo-3-phenyl-1,2-diazetidine-1,2-dicarboxylate [ACD/IUPAC Name]
Dimethyl-(3R)-3-cyclopentyl-4-oxo-3-phenyl-1,2-diazetidin-1,2-dicarboxylat [German] [ACD/IUPAC Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 422.8±48.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.7±3.0 kJ/mol
    Flash Point: 209.5±29.6 °C
    Index of Refraction: 1.586
    Molar Refractivity: 83.8±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.78
    ACD/LogD (pH 5.5): 2.82
    ACD/BCF (pH 5.5): 81.65
    ACD/KOC (pH 5.5): 813.20
    ACD/LogD (pH 7.4): 2.82
    ACD/BCF (pH 7.4): 81.65
    ACD/KOC (pH 7.4): 813.20
    Polar Surface Area: 76 Å2
    Polarizability: 33.2±0.5 10-24cm3
    Surface Tension: 57.7±3.0 dyne/cm
    Molar Volume: 249.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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