ChemSpider 2D Image | 3-(4-benzylpiperidine-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid | C19H25NO3

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

  • Molecular FormulaC19H25NO3
  • Average mass315.407 Da
  • Monoisotopic mass315.183441 Da
  • ChemSpider ID21800891

More details:

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

1142215-07-3 [RN]
3-(4-benzylpiperidine-1-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid
3-[(4-Benzyl-1-piperidinyl)carbonyl]-2,2-dimethylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
3-[(4-Benzyl-1-piperidinyl)carbonyl]-2,2-dimethylcyclopropanecarboxylic acid [ACD/IUPAC Name]
3-[(4-Benzylpiperidin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylic acid
Acide 3-[(4-benzyl-1-pipéridinyl)carbonyl]-2,2-diméthylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2,2-dimethyl-3-[[4-(phenylmethyl)-1-piperidinyl]carbonyl]- [ACD/Index Name]
3-[(4-benzylpiperidin-1-yl)carbonyl]-2,2-dimethylcyclopropanecarboxylicacid

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

MFCD12027548 [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: 502.1±43.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.2±3.0 kJ/mol
    Flash Point: 257.5±28.2 °C
    Index of Refraction: 1.570
    Molar Refractivity: 87.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.98
    ACD/LogD (pH 5.5): 2.35
    ACD/BCF (pH 5.5): 19.77
    ACD/KOC (pH 5.5): 145.86
    ACD/LogD (pH 7.4): 0.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.31
    Polar Surface Area: 58 Å2
    Polarizability: 34.7±0.5 10-24cm3
    Surface Tension: 49.8±3.0 dyne/cm
    Molar Volume: 267.0±3.0 cm3

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