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    Technical details about CAS 185411-12-5, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 185411-12-5

    Manufacturers/Suppliers

    PharmaCompass

    Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

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    2D Structure
    1. Also known as: 185411-12-5, Methyl 3-(trimethylsilyl)pent-4-enoate, Methyl 3-trimethylsilylpent-4-enoate, 3-(trimethylsilyl)-4-pentenoic acid methyl ester, 4-pentenoic acid, 3-(trimethylsilyl)-, methyl ester, Methyl3-(trimethylsilyl)-4-pentenoate
    Molecular Formula
    C9H18O2Si
    Molecular Weight
    186.32  g/mol
    InChI Key
    DJXDHDYQDMVTPZ-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl 3-trimethylsilylpent-4-enoate
    2.1.2 InChI
    InChI=1S/C9H18O2Si/c1-6-8(12(3,4)5)7-9(10)11-2/h6,8H,1,7H2,2-5H3
    2.1.3 InChI Key
    DJXDHDYQDMVTPZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC(=O)CC(C=C)[Si](C)(C)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 185411-12-5

    2. Methyl 3-(trimethylsilyl)pent-4-enoate

    3. Methyl 3-trimethylsilylpent-4-enoate

    4. 3-(trimethylsilyl)-4-pentenoic Acid Methyl Ester

    5. 4-pentenoic Acid, 3-(trimethylsilyl)-, Methyl Ester

    6. Methyl3-(trimethylsilyl)-4-pentenoate

    7. Schembl502858

    8. Dtxsid70392005

    9. Bcp06894

    10. Mfcd01863734

    11. Akos015914428

    12. Am84642

    13. Ds-9303

    14. Methyl3-(trimethylsilyl)pent-4-enoate

    15. Ac-30882

    16. Da-32804

    17. Cs-0022089

    18. Ft-0690003

    19. Methyl 3-(trimethylsilyl)-4-pentenoate, 97%

    20. O11894

    21. A880714

    22. A1-01855

    23. J-650386

    24. J-802239

    2.3 Create Date
    2005-09-08
    3 Chemical and Physical Properties
    Molecular Weight 186.32 g/mol
    Molecular Formula C9H18O2Si
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count5
    Exact Mass186.107606347 g/mol
    Monoisotopic Mass186.107606347 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity170
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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