ChemSpider 2D Image | [1-(1,3-Benzoxazol-2-yl)-3-piperidinyl]acetic acid | C14H16N2O3

[1-(1,3-Benzoxazol-2-yl)-3-piperidinyl]acetic acid

  • Molecular FormulaC14H16N2O3
  • Average mass260.288 Da
  • Monoisotopic mass260.116089 Da
  • ChemSpider ID21800179

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

[1-(1,3-Benzoxazol-2-yl)-3-piperidinyl]acetic acid [ACD/IUPAC Name]
[1-(1,3-Benzoxazol-2-yl)-3-piperidinyl]essigsäure [German] [ACD/IUPAC Name]
[1-(1,3-Benzoxazol-2-yl)piperidin-3-yl]acetic acid
1035840-78-8 [RN]
2-[1-(1,3-benzoxazol-2-yl)piperidin-3-yl]acetic acid
3-Piperidineacetic acid, 1-(2-benzoxazolyl)- [ACD/Index Name]
Acide [1-(1,3-benzoxazol-2-yl)-3-pipéridinyl]acétique [French] [ACD/IUPAC Name]
(1-Benzooxazol-2-ylpiperidin-3-yl)acetic acid
(1-Benzooxazol-2-yl-piperidin-3-yl)acetic acid
(1-Benzooxazol-2-yl-piperidin-3-yl)-acetic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD09701656 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 458.0±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.7±3.0 kJ/mol
    Flash Point: 230.8±26.5 °C
    Index of Refraction: 1.604
    Molar Refractivity: 70.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.32
    ACD/LogD (pH 5.5): 1.42
    ACD/BCF (pH 5.5): 4.49
    ACD/KOC (pH 5.5): 59.15
    ACD/LogD (pH 7.4): -0.37
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 27.8±0.5 10-24cm3
    Surface Tension: 55.4±3.0 dyne/cm
    Molar Volume: 204.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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