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Home > All categories> Biochemicals and Pharmaceutical Chemicals> Pharmaceutical Impurities> 1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
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1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile

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Origin: China

Cas No: 62498-69-5

Specification: 99%min

Min order Quantity: 1 /kg

Supply Ability: 100 mt/month

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  • Products Specification
  • Product Description

  • Property

    CAS No.: 62498-69-5 Formula: C18H17FN2O Molecular Weight: 296.33900

    Description

    A metabolite of Citalopram, an inhibitor of serotonin (5-HT) uptake. Used as an antidepressant.

    Basic Info

    Chemical Name 1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
    Synonyms

    1-(3-Aminopropyl)-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarbonitrile;
    N,N-didesmethylcitalopram;
    Didemethylcitalopram;
    1-(3-amino-propyl)-1-(4-fluoro-phenyl)-1,3-dihydro-isobenzofuran-5-carbonitrile;
    rac-didesmethylcitalopram;
    5-Isobenzofurancarbonitrile,1-(3-aminopropyl)-1-(4-fluorophenyl)-1,3-dihydro;

    CAS No. 62498-69-5
    Molecular Formula C18H17FN2O
    Molecular Weight 296.33900
    PSA 59.04000
    LogP 3.91038

    Properties

    Density 1.24 g/cm3
    Boiling Point 433.1ºC at 760 mmHg
    Flash Point 215.7ºC
    Refractive Index 1.612

    Synthesis Route

    3-chloropropan-1-amine→1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
    rac-1-(4-Fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile+1-Amino-3-chloropropane hydrochloride→1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
    5-BROMO-1-(4-FLUOROPHENYL)-PHTHALIDE→1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile

    Precursor

    1-Amino-3-chloropropane hydrochloride
    rac-1-(4-Fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile
    5-BROMO-1-(4-FLUOROPHENYL)-PHTHALIDE
    3-chloropropan-1-amine

    Downstream Product

    1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
    (1S)-1-(3-aminopropyl)-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile

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