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    CAS 906820-08-4

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    CAS 906820-08-4
    Also known as: 906820-08-4, 4-fluoroisoquinoline-5-sulfonyl chloride hcl, Schembl999448, 4-fluoro-isoquinoline-5-sulfonyl chloride hydrochloride, Bcp31362, Mfcd30342446
    Molecular Formula
    C9H6Cl2FNO2S
    Molecular Weight
    282.12  g/mol
    InChI Key
    CZBQKKWMAVBCJX-UHFFFAOYSA-N
    1 2D Structure

    CAS 906820-08-4

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-fluoroisoquinoline-5-sulfonyl chloride;hydrochloride
    2.1.2 InChI
    InChI=1S/C9H5ClFNO2S.ClH/c10-15(13,14)8-3-1-2-6-4-12-5-7(11)9(6)8;/h1-5H;1H
    2.1.3 InChI Key
    CZBQKKWMAVBCJX-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC2=CN=CC(=C2C(=C1)S(=O)(=O)Cl)F.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 906820-08-4

    2. 4-fluoroisoquinoline-5-sulfonyl Chloride Hcl

    3. Schembl999448

    4. 4-fluoro-isoquinoline-5-sulfonyl Chloride Hydrochloride

    5. Bcp31362

    6. Mfcd30342446

    7. Sb13189

    8. Db-106821

    9. 4-fluoroisoquinoline-5-sulfonylchloridehydrochloride

    2.3 Create Date
    2015-02-02
    3 Chemical and Physical Properties
    Molecular Weight 282.12 g/mol
    Molecular Formula C9H6Cl2FNO2S
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area55.4
    Heavy Atom Count16
    Formal Charge0
    Complexity330
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
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      906820-08-4
      4-Fluoroisoquinoline-5-sulfonyl chl...
      VIDGAS aims to provide our pharmaceutical, Bio pharma, Agrochemical, Food and Fine chemical customers wit...
      VIDGAS aims to provide our pharmaceutical, Bio pharma, Agrochemical, Food and Fine chemical customers with the highest quality SFC and HPLC purification and isolation solutions that market has to offer. With our 25 years of HPLC experience, we are able to provide variety of products with custom tailored answers for even most difficult separations. Our team of professional Chromatographers is available to assist in HPLC and SFC methods development solutions. Here at VIDGAS we are constantly innovating and pursuing the limits of HPLC and SFC.
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