ChemSpider 2D Image | MFCD03088685 | C32H36N4O9

MFCD03088685

  • Molecular FormulaC32H36N4O9
  • Average mass620.650 Da
  • Monoisotopic mass620.248230 Da
  • ChemSpider ID3291739

More details:

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

3,5-Pyridinedicarboxylic acid, 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-1,4-dihydro-2,6-dimethyl-, bis(2-methoxyethyl) ester [ACD/Index Name]
4-[3-(4-Éthoxy-3-nitrophényl)-1-phényl-1H-pyrazol-4-yl]-2,6-diméthyl-1,4-dihydro-3,5-pyridinedicarboxylate de bis(2-méthoxyéthyle) [French] [ACD/IUPAC Name]
Bis(2-methoxyethyl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
Bis(2-methoxyethyl)-4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]
MFCD03088685
1007496-04-9 [RN]
2-methoxyethyl 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-5-[(2-methoxyethyl)oxycarbonyl]-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate
3,5-bis(2-methoxyethyl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
bis(2-methoxyethyl) 4-(3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
bis(2-methoxyethyl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
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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: 746.7±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 108.9±3.0 kJ/mol
    Flash Point: 405.4±32.9 °C
    Index of Refraction: 1.595
    Molar Refractivity: 163.3±0.5 cm3
    #H bond acceptors: 13
    #H bond donors: 1
    #Freely Rotating Bonds: 16
    #Rule of 5 Violations: 3
    ACD/LogP: 5.05
    ACD/LogD (pH 5.5): 5.07
    ACD/BCF (pH 5.5): 4176.40
    ACD/KOC (pH 5.5): 13590.52
    ACD/LogD (pH 7.4): 5.07
    ACD/BCF (pH 7.4): 4180.69
    ACD/KOC (pH 7.4): 13604.44
    Polar Surface Area: 156 Å2
    Polarizability: 64.7±0.5 10-24cm3
    Surface Tension: 47.1±7.0 dyne/cm
    Molar Volume: 480.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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