ChemSpider 2D Image | (2-piperidin-1-ylpyrimidin-5-yl)boronic acid | C9H14BN3O2

(2-piperidin-1-ylpyrimidin-5-yl)boronic acid

  • Molecular FormulaC9H14BN3O2
  • Average mass207.037 Da
  • Monoisotopic mass207.117905 Da
  • ChemSpider ID25950007

More details:

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

(2-(Piperidin-1-yl)pyrimidin-5-yl)boronic acid
(2-piperidin-1-ylpyrimidin-5-yl)boronic acid
[2-(1-Piperidinyl)-5-pyrimidinyl]boronic acid [ACD/IUPAC Name]
[2-(1-Piperidinyl)-5-pyrimidinyl]borsäure [German] [ACD/IUPAC Name]
1002128-86-0 [RN]
Acide [2-(1-pipéridinyl)-5-pyrimidinyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[2-(1-piperidinyl)-5-pyrimidinyl]- [ACD/Index Name]
MFCD07375149 [MDL number]
(2-(Piperidin-1-yl)pyrimidin-5-yl)boronicacid
[1002128-86-0] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 451.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.8±3.0 kJ/mol
    Flash Point: 226.6±31.5 °C
    Index of Refraction: 1.577
    Molar Refractivity: 53.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.44
    ACD/LogD (pH 5.5): 0.28
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.59
    ACD/LogD (pH 7.4): -1.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 69 Å2
    Polarizability: 21.4±0.5 10-24cm3
    Surface Tension: 63.2±5.0 dyne/cm
    Molar Volume: 162.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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