ChemSpider 2D Image | (2,4-Dichlorophenyl){1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl}methanone | C27H27Cl2NO4

(2,4-Dichlorophenyl){1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl}methanone

  • Molecular FormulaC27H27Cl2NO4
  • Average mass500.414 Da
  • Monoisotopic mass499.131714 Da
  • ChemSpider ID3794256

More details:

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

(2,4-Dichlorophényl){1-[(4-éthylphénoxy)méthyl]-6,7-diméthoxy-3,4-dihydro-2(1H)-isoquinoléinyl}méthanone [French] [ACD/IUPAC Name]
(2,4-Dichlorophenyl){1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl}methanone [ACD/IUPAC Name]
(2,4-Dichlorphenyl){1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-2(1H)-isochinolinyl}methanon [German] [ACD/IUPAC Name]
Methanone, (2,4-dichlorophenyl)[1-[(4-ethylphenoxy)methyl]-3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl]- [ACD/Index Name]
(2,4-dichlorophenyl)(1-((4-ethylphenoxy)methyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methanone
(2,4-dichlorophenyl)-[1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methanone
2-(2,4-dichlorobenzoyl)-1-[(4-ethylphenoxy)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
680604-17-5 [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: 651.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.9±3.0 kJ/mol
    Flash Point: 347.5±31.5 °C
    Index of Refraction: 1.594
    Molar Refractivity: 135.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 6.67
    ACD/LogD (pH 5.5): 6.39
    ACD/BCF (pH 5.5): 42190.21
    ACD/KOC (pH 5.5): 71172.01
    ACD/LogD (pH 7.4): 6.39
    ACD/BCF (pH 7.4): 42190.21
    ACD/KOC (pH 7.4): 71172.01
    Polar Surface Area: 48 Å2
    Polarizability: 53.6±0.5 10-24cm3
    Surface Tension: 46.4±3.0 dyne/cm
    Molar Volume: 398.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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