ChemSpider 2D Image | 2-[4-(4-Bromophenyl)-3-methyl-1,2-oxazol-5-yl]-4-hexyl-5-methoxyphenol | C23H26BrNO3

2-[4-(4-Bromophenyl)-3-methyl-1,2-oxazol-5-yl]-4-hexyl-5-methoxyphenol

  • Molecular FormulaC23H26BrNO3
  • Average mass444.361 Da
  • Monoisotopic mass443.109589 Da
  • ChemSpider ID21531885

More details:

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

2-[4-(4-Bromophenyl)-3-methyl-1,2-oxazol-5-yl]-4-hexyl-5-methoxyphenol [ACD/IUPAC Name]
2-[4-(4-Bromophényl)-3-méthyl-1,2-oxazol-5-yl]-4-hexyl-5-méthoxyphénol [French] [ACD/IUPAC Name]
2-[4-(4-Bromphenyl)-3-methyl-1,2-oxazol-5-yl]-4-hexyl-5-methoxyphenol [German] [ACD/IUPAC Name]
Phenol, 2-[4-(4-bromophenyl)-3-methyl-5-isoxazolyl]-4-hexyl-5-methoxy- [ACD/Index Name]
(6E)-6-[4-(4-bromophenyl)-3-methyl-2H-1,2-oxazol-5-ylidene]-4-hexyl-3-methoxycyclohexa-2,4-dien-1-one
129414-84-2 [RN]
2-(4-(4-bromophenyl)-3-methylisoxazol-5-yl)-4-hexyl-5-methoxyphenol
6-[4-(4-bromophenyl)-3-methyl-2H-1,2-oxazol-5-ylidene]-4-hexyl-3-methoxycyclohexa-2,4-dien-1-one
AC1O9SF2
AGN-PC-00YKWC
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 508.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 80.8±3.0 kJ/mol
    Flash Point: 261.1±30.1 °C
    Index of Refraction: 1.571
    Molar Refractivity: 115.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 7.11
    ACD/LogD (pH 5.5): 6.69
    ACD/BCF (pH 5.5): 71918.10
    ACD/KOC (pH 5.5): 104215.18
    ACD/LogD (pH 7.4): 6.65
    ACD/BCF (pH 7.4): 64761.94
    ACD/KOC (pH 7.4): 93845.31
    Polar Surface Area: 55 Å2
    Polarizability: 45.6±0.5 10-24cm3
    Surface Tension: 43.4±3.0 dyne/cm
    Molar Volume: 349.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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