ChemSpider 2D Image | 3-(4-acetylpiperazine-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid | C13H20N2O4

3-(4-acetylpiperazine-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid

  • Molecular FormulaC13H20N2O4
  • Average mass268.309 Da
  • Monoisotopic mass268.142303 Da
  • ChemSpider ID21800881

More details:

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

1142214-80-9 [RN]
3-(4-acetylpiperazine-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid
3-[(4-Acetyl-1-piperazinyl)carbonyl]-2,2-dimethylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
3-[(4-Acetyl-1-piperazinyl)carbonyl]-2,2-dimethylcyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide 3-[(4-acétyl-1-pipérazinyl)carbonyl]-2,2-diméthylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 3-[(4-acetyl-1-piperazinyl)carbonyl]-2,2-dimethyl- [ACD/Index Name]
3-(4-acetylpiperazine-1-carbonyl)-2,2-dimethylcyclopropanecarboxylic acid
3-(4-Acetyl-piperazine-1-carbonyl)-2,2-dimethyl-cyclopropanecarboxylic acid
3-[(4-Acetylpiperazin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylic acid
3-[(4-acetylpiperazin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylicacid
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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: 510.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.8 mmHg at 25°C
    Enthalpy of Vaporization: 85.5±6.0 kJ/mol
    Flash Point: 262.5±30.1 °C
    Index of Refraction: 1.544
    Molar Refractivity: 66.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.71
    ACD/LogD (pH 5.5): -0.88
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.58
    ACD/LogD (pH 7.4): -2.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 78 Å2
    Polarizability: 26.4±0.5 10-24cm3
    Surface Tension: 52.9±3.0 dyne/cm
    Molar Volume: 211.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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