ChemSpider 2D Image | 2-{(E)-[(2-{[4-(Diphenylamino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino}phenyl)imino]methyl}-4-nitrophenol | C33H30N8O3

2-{(E)-[(2-{[4-(Diphenylamino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino}phenyl)imino]methyl}-4-nitrophenol

  • Molecular FormulaC33H30N8O3
  • Average mass586.643 Da
  • Monoisotopic mass586.244080 Da
  • ChemSpider ID13062569

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{(E)-[(2-{[4-(Diphenylamino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino}phenyl)imino]methyl}-4-nitrophenol [ACD/IUPAC Name]
2-{(E)-[(2-{[4-(Diphenylamino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino}phenyl)imino]methyl}-4-nitrophenol [German] [ACD/IUPAC Name]
2-{(E)-[(2-{[4-(Diphénylamino)-6-(1-pipéridinyl)-1,3,5-triazin-2-yl]amino}phényl)imino]méthyl}-4-nitrophénol [French] [ACD/IUPAC Name]
Phenol, 2-[(E)-[[2-[[4-(diphenylamino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]amino]phenyl]imino]methyl]-4-nitro- [ACD/Index Name]
2-((1E)-((2-((4-(diphenylamino)-6-(piperidin-1-yl)-1,3,5-triazin-2(5H)-ylidene)amino)phenyl)imino)methyl)-4-nitrophenol
2-{(E)-[(2-{[4-(diphenylamino)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}phenyl)imino]methyl}-4-nitrophenol
2-{[2-(4-Diphenylamino-6-piperidin-1-yl-[1,3,5]triazin-2-ylamino)-phenylimino]-methyl}-4-nitro-phenol
732255-73-1 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 825.6±75.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.1 mmHg at 25°C
    Enthalpy of Vaporization: 124.1±3.0 kJ/mol
    Flash Point: 453.1±37.1 °C
    Index of Refraction: 1.696
    Molar Refractivity: 169.0±0.5 cm3
    #H bond acceptors: 11
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 3
    ACD/LogP: 5.45
    ACD/LogD (pH 5.5): 5.22
    ACD/BCF (pH 5.5): 4427.63
    ACD/KOC (pH 5.5): 11097.15
    ACD/LogD (pH 7.4): 3.72
    ACD/BCF (pH 7.4): 141.91
    ACD/KOC (pH 7.4): 355.68
    Polar Surface Area: 136 Å2
    Polarizability: 67.0±0.5 10-24cm3
    Surface Tension: 59.0±7.0 dyne/cm
    Molar Volume: 439.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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