ChemSpider 2D Image | (8E)-2-Amino-8-(3,4,5-trimethoxybenzylidene)-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile | C29H32N2O7

(8E)-2-Amino-8-(3,4,5-trimethoxybenzylidene)-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

  • Molecular FormulaC29H32N2O7
  • Average mass520.574 Da
  • Monoisotopic mass520.220947 Da
  • ChemSpider ID4448105

  • Double-bond stereo - Double-bond stereo

More details:

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

(8E)-2-Amino-8-(3,4,5-trimethoxybenzyliden)-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-chromen-3-carbonitril [German] [ACD/IUPAC Name]
(8E)-2-Amino-8-(3,4,5-trimethoxybenzylidene)-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile [ACD/IUPAC Name]
(8E)-2-Amino-8-(3,4,5-triméthoxybenzylidène)-4-(3,4,5-triméthoxyphényl)-5,6,7,8-tétrahydro-4H-chromène-3-carbonitrile [French] [ACD/IUPAC Name]
4H-1-Benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-4-(3,4,5-trimethoxyphenyl)-8-[(3,4,5-trimethoxyphenyl)methylene]-, (8E)- [ACD/Index Name]
(8E)-2-amino-4-(3,4,5-trimethoxyphenyl)-8-[(3,4,5-trimethoxyphenyl)methylidene]-4,5,6,7-tetrahydrochromene-3-carbonitrile
1904587-79-6 [RN]
2-amino-4-(3,4,5-trimethoxyphenyl)-8-[(3,4,5-trimethoxyphenyl)methylene]-4H-5,6,7-trihydrochromene-3-carbonitrile
339583-07-2 [RN]
DJQXVTIJYFNVGK-LICLKQGHSA-N

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

A0534/0024640 [DBID]
AK-968/11318458 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 734.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 107.1±3.0 kJ/mol
    Flash Point: 397.9±32.9 °C
    Index of Refraction: 1.609
    Molar Refractivity: 140.4±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 3.19
    ACD/LogD (pH 5.5): 3.47
    ACD/BCF (pH 5.5): 254.79
    ACD/KOC (pH 5.5): 1823.90
    ACD/LogD (pH 7.4): 3.48
    ACD/BCF (pH 7.4): 260.88
    ACD/KOC (pH 7.4): 1867.48
    Polar Surface Area: 114 Å2
    Polarizability: 55.7±0.5 10-24cm3
    Surface Tension: 56.8±5.0 dyne/cm
    Molar Volume: 405.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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