ChemSpider 2D Image | Ethyl 4-chloro-2-(3-pyridinyl)-5-pyrimidinecarboxylate | C12H10ClN3O2

Ethyl 4-chloro-2-(3-pyridinyl)-5-pyrimidinecarboxylate

  • Molecular FormulaC12H10ClN3O2
  • Average mass263.680 Da
  • Monoisotopic mass263.046143 Da
  • ChemSpider ID21393900

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

34775-04-7 [RN]
4-Chloro-2-(3-pyridinyl)-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-chloro-2-(3-pyridinyl)-, ethyl ester [ACD/Index Name]
Ethyl 4-chloro-2-(3-pyridinyl)-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl 4-chloro-2-(pyridin-3-yl)pyrimidine-5-carboxylate
Ethyl-4-chlor-2-(3-pyridinyl)-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
[34775-04-7] [RN]
3-[4-Chloro-5-(ethoxycarbonyl)pyrimidin-2-yl]pyridine
4-Chloro-5-(ethoxycarbonyl)-2-(pyridin-3-yl)pyrimidine
4-Chloro-5-(ethoxycarbonyl)-2-(pyridin-3-yl)pyrimidine, 3-[4-Chloro-5-(ethoxycarbonyl)pyrimidin-2-yl]pyridine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 336.5±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.0±3.0 kJ/mol
    Flash Point: 157.3±25.7 °C
    Index of Refraction: 1.576
    Molar Refractivity: 66.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.29
    ACD/LogD (pH 5.5): 1.91
    ACD/BCF (pH 5.5): 16.64
    ACD/KOC (pH 5.5): 260.41
    ACD/LogD (pH 7.4): 1.91
    ACD/BCF (pH 7.4): 16.65
    ACD/KOC (pH 7.4): 260.57
    Polar Surface Area: 65 Å2
    Polarizability: 26.3±0.5 10-24cm3
    Surface Tension: 53.8±3.0 dyne/cm
    Molar Volume: 200.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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