ChemSpider 2D Image | (1-{[4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}-4-piperidinyl)acetic acid | C17H24N2O5

(1-{[4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}-4-piperidinyl)acetic acid

  • Molecular FormulaC17H24N2O5
  • Average mass336.383 Da
  • Monoisotopic mass336.168518 Da
  • ChemSpider ID21801570

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

(1-{[4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}-4-piperidinyl)acetic acid [ACD/IUPAC Name]
(1-{[4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}-4-piperidinyl)essigsäure [German] [ACD/IUPAC Name]
(1-{[4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl}piperidin-4-yl)acetic acid
1142202-84-3 [RN]
4-Piperidineacetic acid, 1-[[4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrrol-2-yl]carbonyl]- [ACD/Index Name]
Acide (1-{[4-(éthoxycarbonyl)-3,5-diméthyl-1H-pyrrol-2-yl]carbonyl}-4-pipéridinyl)acétique [French] [ACD/IUPAC Name]
(1-([4-(ETHOXYCARBONYL)-3,5-DIMETHYL-1H-PYRROL-2-YL]CARBONYL)PIPERIDIN-4-YL)ACETIC ACID
(1-{[4-(ethoxycarbonyl)-3,5-dimethyl-1h-pyrrol-2-yl]carbonyl}piperidin-4-yl)aceticacid
[1142202-84-3] [RN]
2-(1-(4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidin-4-yl)acetic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD12028249 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.2±0.1 g/cm3
    Boiling Point: 609.6±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 95.2±3.0 kJ/mol
    Flash Point: 322.5±31.5 °C
    Index of Refraction: 1.558
    Molar Refractivity: 87.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 0.98
    ACD/LogD (pH 5.5): 0.76
    ACD/BCF (pH 5.5): 1.41
    ACD/KOC (pH 5.5): 25.82
    ACD/LogD (pH 7.4): -1.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 100 Å2
    Polarizability: 34.7±0.5 10-24cm3
    Surface Tension: 51.4±3.0 dyne/cm
    Molar Volume: 272.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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