ChemSpider 2D Image | [1-(3,4,5-Trimethoxybenzoyl)-4-piperidinyl]acetic acid | C17H23NO6

[1-(3,4,5-Trimethoxybenzoyl)-4-piperidinyl]acetic acid

  • Molecular FormulaC17H23NO6
  • Average mass337.368 Da
  • Monoisotopic mass337.152527 Da
  • ChemSpider ID21801659

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

[1-(3,4,5-Trimethoxybenzoyl)-4-piperidinyl]acetic acid [ACD/IUPAC Name]
[1-(3,4,5-Trimethoxybenzoyl)-4-piperidinyl]essigsäure [German] [ACD/IUPAC Name]
[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]acetic acid
1030422-06-0 [RN]
2-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]acetic acid
4-Piperidineacetic acid, 1-(3,4,5-trimethoxybenzoyl)- [ACD/Index Name]
Acide [1-(3,4,5-triméthoxybenzoyl)-4-pipéridinyl]acétique [French] [ACD/IUPAC Name]
[1-(3,4,5-Trimethoxybenzoyl)piperidin-4-yl]-acetic acid
[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]-aceticacid
[1030422-06-0] [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD12028337 [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: 559.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 88.5±3.0 kJ/mol
    Flash Point: 292.0±30.1 °C
    Index of Refraction: 1.538
    Molar Refractivity: 87.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.05
    ACD/LogD (pH 5.5): 0.81
    ACD/BCF (pH 5.5): 1.54
    ACD/KOC (pH 5.5): 27.44
    ACD/LogD (pH 7.4): -0.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 85 Å2
    Polarizability: 34.6±0.5 10-24cm3
    Surface Tension: 45.1±3.0 dyne/cm
    Molar Volume: 278.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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