ChemSpider 2D Image | 2-[(2E)-2-(4-Methoxybenzylidene)hydrazino]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one | C32H32N4O3

2-[(2E)-2-(4-Methoxybenzylidene)hydrazino]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID7930611

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(2E)-2-(4-Methoxybenzylidene)hydrazino]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one [ACD/IUPAC Name]
Benzaldehyde, 4-methoxy-, 1-[2-[4,6-dihydro-3-(4-methoxyphenyl)-4-oxospiro[benzo[h]quinazoline-5(3H),1'-cyclohexan]-2-yl]hydrazone] [ACD/Index Name]
2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
3-(4-methoxyphenyl)-2-[(2E)-2-[(4-methoxyphenyl)methylidene]hydrazinyl]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
487015-29-2 [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: 703.2±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 102.9±3.0 kJ/mol
    Flash Point: 379.1±35.7 °C
    Index of Refraction: 1.652
    Molar Refractivity: 151.6±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 7.77
    ACD/LogD (pH 5.5): 6.88
    ACD/BCF (pH 5.5): 99335.32
    ACD/KOC (pH 5.5): 131371.52
    ACD/LogD (pH 7.4): 6.88
    ACD/BCF (pH 7.4): 99339.03
    ACD/KOC (pH 7.4): 131376.41
    Polar Surface Area: 76 Å2
    Polarizability: 60.1±0.5 10-24cm3
    Surface Tension: 49.2±7.0 dyne/cm
    Molar Volume: 414.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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