ChemSpider 2D Image | [2-(4-Acetyl-1-piperazinyl)-4-pyridinyl]boronic acid | C11H16BN3O3

[2-(4-Acetyl-1-piperazinyl)-4-pyridinyl]boronic acid

  • Molecular FormulaC11H16BN3O3
  • Average mass249.074 Da
  • Monoisotopic mass249.128479 Da
  • ChemSpider ID62123285

More details:

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

[2-(4-Acetyl-1-piperazinyl)-4-pyridinyl]boronic acid [ACD/IUPAC Name]
[2-(4-Acetyl-1-piperazinyl)-4-pyridinyl]borsäure [German] [ACD/IUPAC Name]
Acide [2-(4-acétyl-1-pipérazinyl)-4-pyridinyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[2-(4-acetyl-1-piperazinyl)-4-pyridinyl]- [ACD/Index Name]
1214879-90-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 556.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 290.5±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): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.13
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

Click to predict properties on the Chemicalize site


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