ChemSpider 2D Image | 2,5-Dioxo-1-pyrrolidinyl N-acetyl-beta-alaninate | C9H12N2O5

2,5-Dioxo-1-pyrrolidinyl N-acetyl-β-alaninate

  • Molecular FormulaC9H12N2O5
  • Average mass228.202 Da
  • Monoisotopic mass228.074615 Da
  • ChemSpider ID21588171

More details:

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

2,5-Dioxo-1-pyrrolidinyl N-acetyl-β-alaninate [ACD/IUPAC Name]
2,5-Dioxo-1-pyrrolidinyl-N-acetyl-β-alaninat [German] [ACD/IUPAC Name]
N-Acétyl-β-alaninate de 2,5-dioxo-1-pyrrolidinyle [French] [ACD/IUPAC Name]
β-Alanine, N-acetyl-, 2,5-dioxo-1-pyrrolidinyl ester [ACD/Index Name]
(2,5-dioxopyrrolidin-1-yl) 3-acetamidopropanoate
154194-69-1 [RN]
2,5-dioxopyrrolidin-1-yl 3-acetamidopropanoate
2,5-Dioxopyrrolidin-1-yl N-acetyl-β-alaninate
N-Acetyl-??-alanine N-Hydroxysuccinimide Ester
N-Acetyl-?-alanine N-Hydroxysuccinimide Ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.525
    Molar Refractivity: 51.4±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: -2.77
    ACD/LogD (pH 5.5): -1.54
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.46
    ACD/LogD (pH 7.4): -1.54
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.46
    Polar Surface Area: 93 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 54.8±5.0 dyne/cm
    Molar Volume: 167.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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