ChemSpider 2D Image | 2-(4-Acetamidophenoxy)ethyl isopropyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate | C28H31N3O8

2-(4-Acetamidophenoxy)ethyl isopropyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate

  • Molecular FormulaC28H31N3O8
  • Average mass537.561 Da
  • Monoisotopic mass537.211121 Da
  • ChemSpider ID2762253

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

2-(4-Acetamidophenoxy)ethyl isopropyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
2-(4-Acetamidophenoxy)ethyl-isopropyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]
2,6-Diméthyl-4-(2-nitrophényl)-1,4-dihydro-3,5-pyridinedicarboxylate de 2-(4-acétamidophénoxy)éthyle et d'isopropyle [French] [ACD/IUPAC Name]
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-nitrophenyl)-, 2-[4-(acetylamino)phenoxy]ethyl 1-methylethyl ester [ACD/Index Name]
3-(2-(4-acetamidophenoxy)ethyl) 5-isopropyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
3-{2-[4-(acetylamino)phenoxy]ethyl} 5-isopropyl 4-{2-nitrophenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
3-O-[2-(4-acetamidophenoxy)ethyl] 5-O-propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
92564-98-2 [RN]
AC1MRSEY
AGN-PC-0KVUG5
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AQ-405/42300193 [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: 726.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.0±3.0 kJ/mol
    Flash Point: 393.0±32.9 °C
    Index of Refraction: 1.587
    Molar Refractivity: 142.3±0.3 cm3
    #H bond acceptors: 11
    #H bond donors: 2
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 4.72
    ACD/LogD (pH 5.5): 4.65
    ACD/BCF (pH 5.5): 2020.23
    ACD/KOC (pH 5.5): 8079.57
    ACD/LogD (pH 7.4): 4.65
    ACD/BCF (pH 7.4): 2023.71
    ACD/KOC (pH 7.4): 8093.46
    Polar Surface Area: 149 Å2
    Polarizability: 56.4±0.5 10-24cm3
    Surface Tension: 51.3±3.0 dyne/cm
    Molar Volume: 423.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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