ChemSpider 2D Image | [3-({4-[2-(2-Methoxyethoxy)ethyl]-1-piperazinyl}carbonyl)phenyl]boronic acid | C16H25BN2O5

[3-({4-[2-(2-Methoxyethoxy)ethyl]-1-piperazinyl}carbonyl)phenyl]boronic acid

  • Molecular FormulaC16H25BN2O5
  • Average mass336.191 Da
  • Monoisotopic mass336.185638 Da
  • ChemSpider ID72919548

More details:






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

[3-({4-[2-(2-Methoxyethoxy)ethyl]-1-piperazinyl}carbonyl)phenyl]boronic acid [ACD/IUPAC Name]
[3-({4-[2-(2-Methoxyethoxy)ethyl]-1-piperazinyl}carbonyl)phenyl]borsäure [German] [ACD/IUPAC Name]
Acide [3-({4-[2-(2-méthoxyéthoxy)éthyl]-1-pipérazinyl}carbonyl)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[[4-[2-(2-methoxyethoxy)ethyl]-1-piperazinyl]carbonyl]phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 536.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 278.3±32.9 °C
Index of Refraction: 1.563
Molar Refractivity: 88.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -0.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.08
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 23.20
Polar Surface Area: 82 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 53.3±5.0 dyne/cm
Molar Volume: 273.8±5.0 cm3

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