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Search term: GXMQXDIBKRLEFV-UFWORHAWSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 4-Bromo-2-{(E)-[(3-chloro-4-fluorophenyl)imino]methyl}-6-ethoxyphenol | C15H12BrClFNO2

4-Bromo-2-{(E)-[(3-chloro-4-fluorophenyl)imino]methyl}-6-ethoxyphenol

  • Molecular FormulaC15H12BrClFNO2
  • Average mass372.617 Da
  • Monoisotopic mass370.972382 Da
  • ChemSpider ID21511056
  • Double-bond stereo - Double-bond stereo


More details:






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

4-Brom-2-{(E)-[(3-chlor-4-fluorphenyl)imino]methyl}-6-ethoxyphenol [German] [ACD/IUPAC Name]
4-Bromo-2-{(E)-[(3-chloro-4-fluorophenyl)imino]methyl}-6-ethoxyphenol [ACD/IUPAC Name]
4-Bromo-2-{(E)-[(3-chloro-4-fluorophényl)imino]méthyl}-6-éthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 4-bromo-2-[(E)-[(3-chloro-4-fluorophenyl)imino]methyl]-6-ethoxy- [ACD/Index Name]
4-BROMO-2-[(1E)-[(3-CHLORO-4-FLUOROPHENYL)IMINO]METHYL]-6-ETHOXYPHENOL
4-bromo-2-{[(3-chloro-4-fluorophenyl)imino]methyl}-6-ethoxyphenol [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 477.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.0±3.0 kJ/mol
Flash Point: 242.6±28.7 °C
Index of Refraction: 1.586
Molar Refractivity: 83.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 5.56
ACD/BCF (pH 5.5): 9953.43
ACD/KOC (pH 5.5): 25250.55
ACD/LogD (pH 7.4): 5.34
ACD/BCF (pH 7.4): 6005.17
ACD/KOC (pH 7.4): 15234.32
Polar Surface Area: 42 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 249.5±7.0 cm3

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