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Search term: WELRJRPRFFDJKE-DHRITJCHSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-[(E)-{[5-(5-Chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl]-6-ethoxyphenol | C23H19ClN2O3

2-[(E)-{[5-(5-Chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl]-6-ethoxyphenol

  • Molecular FormulaC23H19ClN2O3
  • Average mass406.862 Da
  • Monoisotopic mass406.108429 Da
  • ChemSpider ID21538042
  • Double-bond stereo - Double-bond stereo


More details:






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

2-[(E)-{[5-(5-Chlor-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl]-6-ethoxyphenol [German] [ACD/IUPAC Name]
2-[(E)-{[5-(5-Chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]imino}methyl]-6-ethoxyphenol [ACD/IUPAC Name]
2-[(E)-{[5-(5-Chloro-1,3-benzoxazol-2-yl)-2-méthylphényl]imino}méthyl]-6-éthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 2-[(E)-[[5-(5-chloro-2-benzoxazolyl)-2-methylphenyl]imino]methyl]-6-ethoxy- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 567.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 297.3±30.1 °C
Index of Refraction: 1.630
Molar Refractivity: 112.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.41
ACD/LogD (pH 5.5): 5.63
ACD/BCF (pH 5.5): 11086.51
ACD/KOC (pH 5.5): 27329.56
ACD/LogD (pH 7.4): 5.59
ACD/BCF (pH 7.4): 10142.63
ACD/KOC (pH 7.4): 25002.78
Polar Surface Area: 68 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 315.8±7.0 cm3

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