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    European CDMO and Gx manufacturer with 75 years of experience in delivering premium APIs to pharmaceutical partners worldwide.

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    Granules India Limited has high volume world-class facilities for APIs, PFIs, & FDFs, serving customers in over 80 countries.

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    BUILDING BLOCK

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    Chemistry

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    Also known as: Ethyl 3-phenoxypropanoate, 22409-91-2, Nsc406928, Propanoic acid, 3-phenoxy-ethyl ester, Ethyl3-phenoxypropanoate, Schembl38664
    Molecular Formula
    C11H14O3
    Molecular Weight
    194.23  g/mol
    InChI Key
    TXKJOPXGYSFUNC-UHFFFAOYSA-N
    CAS 22409-91-2
    1 2D Structure

    CAS 22409-91-2

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    ethyl 3-phenoxypropanoate
    2.1.2 InChI
    InChI=1S/C11H14O3/c1-2-13-11(12)8-9-14-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
    2.1.3 InChI Key
    TXKJOPXGYSFUNC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCOC(=O)CCOC1=CC=CC=C1
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Ethyl 3-phenoxypropanoate

    2. 22409-91-2

    3. Nsc406928

    4. Propanoic Acid, 3-phenoxy-ethyl Ester

    5. Ethyl3-phenoxypropanoate

    6. Schembl38664

    7. Dtxsid50324526

    8. Txkjopxgysfunc-uhfffaoysa-n

    9. Amy25615

    10. Mfcd00026919

    11. Akos007930362

    12. Nsc-406928

    13. Propanoic Acid, 3-phenoxy-, Ethyl Ester

    14. As-58619

    15. Db-045903

    16. A816183

    17. J-014693

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 194.23 g/mol
    Molecular Formula C11H14O3
    XLogP32.1
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count6
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area35.5
    Heavy Atom Count14
    Formal Charge0
    Complexity162
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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