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Search term: IWVZPBHTBPZUTL-WYMPLXKRSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-[(5-Benzooxazol-2-yl-2-methoxy-phenylimino)-methyl]-4-bromo-6-methoxy-phenol | C22H17BrN2O4

2-[(5-Benzooxazol-2-yl-2-methoxy-phenylimino)-methyl]-4-bromo-6-methoxy-phenol

  • Molecular FormulaC22H17BrN2O4
  • Average mass453.285 Da
  • Monoisotopic mass452.037170 Da
  • ChemSpider ID17725859

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(5-Benzooxazol-2-yl-2-methoxy-phenylimino)-methyl]-4-bromo-6-methoxy-phenol
2-[(E)-{[5-(1,3-Benzoxazol-2-yl)-2-methoxyphenyl]imino}methyl]-4-brom-6-methoxyphenol [German] [ACD/IUPAC Name]
2-[(E)-{[5-(1,3-Benzoxazol-2-yl)-2-methoxyphenyl]imino}methyl]-4-bromo-6-methoxyphenol [ACD/IUPAC Name]
2-[(E)-{[5-(1,3-Benzoxazol-2-yl)-2-méthoxyphényl]imino}méthyl]-4-bromo-6-méthoxyphénol [French] [ACD/IUPAC Name]
Phenol, 2-[(E)-[[5-(2-benzoxazolyl)-2-methoxyphenyl]imino]methyl]-4-bromo-6-methoxy- [ACD/Index Name]
(E)-2-(((5-(benzo[d]oxazol-2-yl)-2-methoxyphenyl)imino)methyl)-4-bromo-6-methoxyphenol
321963-49-9 [RN]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 616.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 94.8±3.0 kJ/mol
    Flash Point: 326.6±31.5 °C
    Index of Refraction: 1.644
    Molar Refractivity: 112.1±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 7.16
    ACD/LogD (pH 5.5): 5.64
    ACD/BCF (pH 5.5): 11348.35
    ACD/KOC (pH 5.5): 27755.70
    ACD/LogD (pH 7.4): 5.47
    ACD/BCF (pH 7.4): 7759.06
    ACD/KOC (pH 7.4): 18977.05
    Polar Surface Area: 77 Å2
    Polarizability: 44.4±0.5 10-24cm3
    Surface Tension: 48.3±7.0 dyne/cm
    Molar Volume: 309.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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