ChemSpider 2D Image | 3-({1-[(TERT-BUTOXY)CARBONYL]PIPERIDIN-3-YL}METHOXY)BENZOIC ACID | C18H25NO5

3-({1-[(TERT-BUTOXY)CARBONYL]PIPERIDIN-3-YL}METHOXY)BENZOIC ACID

  • Molecular FormulaC18H25NO5
  • Average mass335.395 Da
  • Monoisotopic mass335.173279 Da
  • ChemSpider ID26457295

More details:

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

1217862-74-2 [RN]
1-Piperidinecarboxylic acid, 3-[(3-carboxyphenoxy)methyl]-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
3-({1-[(TERT-BUTOXY)CARBONYL]PIPERIDIN-3-YL}METHOXY)BENZOIC ACID
3-[(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-piperidinyl)methoxy]benzoesäure [German] [ACD/IUPAC Name]
3-[(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-piperidinyl)methoxy]benzoic acid [ACD/IUPAC Name]
Acide 3-[(1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-3-pipéridinyl)méthoxy]benzoïque [French] [ACD/IUPAC Name]
1-piperidinecarboxylic acid, 3-[(3-carboxyphenoxy)methyl], 1-(1,1-dimethylethyl) ester
3-((1-(tert-Butoxycarbonyl)piperidin-3-yl)methoxy)benzoic acid
3-([1-(tert-butoxycarbonyl)piperidin-3-yl]methoxy)benzoic acid
3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]methoxy]benzoic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 483.9±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.9±3.0 kJ/mol
    Flash Point: 246.4±20.4 °C
    Index of Refraction: 1.535
    Molar Refractivity: 89.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.47
    ACD/LogD (pH 5.5): 2.40
    ACD/BCF (pH 5.5): 17.52
    ACD/KOC (pH 5.5): 104.59
    ACD/LogD (pH 7.4): 0.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.43
    Polar Surface Area: 76 Å2
    Polarizability: 35.4±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 286.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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