ChemSpider 2D Image | 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethylcyclopropane-1-carboxylic acid | C19H26N2O3

3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethylcyclopropane-1-carboxylic acid

  • Molecular FormulaC19H26N2O3
  • Average mass330.421 Da
  • Monoisotopic mass330.194336 Da
  • ChemSpider ID21800883

More details:

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

1142214-86-5 [RN]
3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2,2-dimethylcyclopropane-1-carboxylic acid
3-{[4-(2,5-Dimethylphenyl)-1-piperazinyl]carbonyl}-2,2-dimethylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
3-{[4-(2,5-Dimethylphenyl)-1-piperazinyl]carbonyl}-2,2-dimethylcyclopropanecarboxylic acid [ACD/IUPAC Name]
3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl}-2,2-dimethylcyclopropanecarboxylic acid
Acide 3-{[4-(2,5-diméthylphényl)-1-pipérazinyl]carbonyl}-2,2-diméthylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]carbonyl]-2,2-dimethyl- [ACD/Index Name]
3-(4-(2,5-dimethylphenyl)piperazine-1-carbonyl)-2,2-dimethylcyclopropanecarboxylic acid
3-{[4-(2,5-Dimethylphenyl)piperazin-1-yl]-carbonyl}-2,2-dimethylcyclopropanecarboxylic acid
3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]-carbonyl}-2,2-dimethylcyclopropanecarboxylicacid

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

MFCD12027540 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 545.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.7±3.0 kJ/mol
    Flash Point: 283.5±30.1 °C
    Index of Refraction: 1.576
    Molar Refractivity: 91.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.11
    ACD/LogD (pH 5.5): 1.52
    ACD/BCF (pH 5.5): 4.63
    ACD/KOC (pH 5.5): 51.57
    ACD/LogD (pH 7.4): -0.28
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 61 Å2
    Polarizability: 36.3±0.5 10-24cm3
    Surface Tension: 49.7±3.0 dyne/cm
    Molar Volume: 276.5±3.0 cm3

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