ChemSpider 2D Image | (6-(4-Acetylpiperazin-1-yl)pyridin-3-yl)boronic acid | C11H16BN3O3

(6-(4-Acetylpiperazin-1-yl)pyridin-3-yl)boronic acid

  • Molecular FormulaC11H16BN3O3
  • Average mass249.074 Da
  • Monoisotopic mass249.128479 Da
  • ChemSpider ID28537221

More details:

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

(6-(4-Acetylpiperazin-1-yl)pyridin-3-yl)boronic acid
[6-(4-Acetyl-1-piperazinyl)-3-pyridinyl]boronic acid [ACD/IUPAC Name]
[6-(4-Acetyl-1-piperazinyl)-3-pyridinyl]borsäure [German] [ACD/IUPAC Name]
1236360-37-4 [RN]
Acide [6-(4-acétyl-1-pipérazinyl)-3-pyridinyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[6-(4-acetyl-1-piperazinyl)-3-pyridinyl]- [ACD/Index Name]
(6-(4-Acetylpiperazin-1-yl)-pyridin-3-yl)boronic acid
[1236360-37-4] [RN]
[6-(4-acetylpiperazin-1-yl)pyridin-3-yl]boronic acid
2-(4-acetylpiperazin-1-yl)pyridine-5-boronic acid
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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: 543.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.5±3.0 kJ/mol
    Flash Point: 282.3±32.9 °C
    Index of Refraction: 1.599
    Molar Refractivity: 64.7±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.62
    ACD/LogD (pH 5.5): -1.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 77 Å2
    Polarizability: 25.7±0.5 10-24cm3
    Surface Tension: 63.2±5.0 dyne/cm
    Molar Volume: 189.5±5.0 cm3

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