ChemSpider 2D Image | {4-[2-(1H-Imidazol-1-yl)ethoxy]phenyl}acetic acid | C13H14N2O3

{4-[2-(1H-Imidazol-1-yl)ethoxy]phenyl}acetic acid

  • Molecular FormulaC13H14N2O3
  • Average mass246.262 Da
  • Monoisotopic mass246.100449 Da
  • ChemSpider ID23128941

More details:

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

{4-[2-(1H-Imidazol-1-yl)ethoxy]phenyl}acetic acid [ACD/IUPAC Name]
{4-[2-(1H-Imidazol-1-yl)ethoxy]phenyl}essigsäure [German] [ACD/IUPAC Name]
Acide {4-[2-(1H-imidazol-1-yl)éthoxy]phényl}acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 4-[2-(1H-imidazol-1-yl)ethoxy]- [ACD/Index Name]
[4-(2-Imidazol-1-yl-ethoxy)-phenyl]-acetic acid
97315-34-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 508.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 261.4±25.9 °C
Index of Refraction: 1.584
Molar Refractivity: 67.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 201.5±7.0 cm3

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