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    CAS 330792-68-2

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    CAS 330792-68-2
    Also known as: 330792-68-2, 2-[hydroxy(4-phenoxyphenyl)methylene]malononitrile, Propanedinitrile, 2-[hydroxy(4-phenoxyphenyl)methylene]-, 2-[hydroxy-(4-phenoxyphenyl)methylidene]propanedinitrile, Mfcd20270362, 1,1-dicyano-2-hydroxy-2-(4-phenoxyphenyl)ethene
    Molecular Formula
    C16H10N2O2
    Molecular Weight
    262.26  g/mol
    InChI Key
    MWTPPIZIKZHMSK-UHFFFAOYSA-N
    1 2D Structure

    CAS 330792-68-2

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[hydroxy-(4-phenoxyphenyl)methylidene]propanedinitrile
    2.1.2 InChI
    InChI=1S/C16H10N2O2/c17-10-13(11-18)16(19)12-6-8-15(9-7-12)20-14-4-2-1-3-5-14/h1-9,19H
    2.1.3 InChI Key
    MWTPPIZIKZHMSK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=C(C#N)C#N)O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 330792-68-2

    2. 2-[hydroxy(4-phenoxyphenyl)methylene]malononitrile

    3. Propanedinitrile, 2-[hydroxy(4-phenoxyphenyl)methylene]-

    4. 2-[hydroxy-(4-phenoxyphenyl)methylidene]propanedinitrile

    5. Mfcd20270362

    6. 1,1-dicyano-2-hydroxy-2-(4-phenoxyphenyl)ethene

    7. Schembl202753

    8. Propanedinitrile, [hydroxy(4-phenoxyphenyl)methylene]-

    9. Bcp14807

    10. Cs-m2594

    11. Ac-29709

    12. Cs-14789

    13. Sy126889

    14. W11659

    15. A875440

    16. 2-[hydroxy-(4-phenoxy-phenyl)-methylene]malononitrile

    17. 2-[hydroxy-(4-phenoxy-phenyl)-methylene]-malononitrile

    18. Propanedinitrile,2-[hydroxy(4-phenoxyphenyl)methylene]-

    2.3 Create Date
    2007-12-05
    3 Chemical and Physical Properties
    Molecular Weight 262.26 g/mol
    Molecular Formula C16H10N2O2
    XLogP33
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area77
    Heavy Atom Count20
    Formal Charge0
    Complexity433
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      2-(Hydroxyl(4-phenoxyphenyl)methylene)malanonitrile

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      Ibrutinib
      Integrin Life Sciences Pvt. Ltd. is one of the growing pharmaceutical API, advanced chemical intermediate...
      Integrin Life Sciences Pvt. Ltd. is one of the growing pharmaceutical API, advanced chemical intermediates manufacturing companies in India. Our Plant is Located in Jaggaiahpet APIIC Industrial Estate, Krishna District, Near the National highway from Hyderabad to Vijayawada, from Hyderabad Airport to 200 km. Integrin is Managed by young entrepreneurs having vast experience in various fields like R & D, production, and marketing of active pharmaceutical ingredients. Integrin life sciences in multi Therapeutic SegmentsLike AntiUlcer, AntiPsychotics, Anti Histamines Anti Fungal and AntiDepressants.
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        Ibrutinib
        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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