loader
Please Wait
Applying Filters...

AbbVie Header AbbVie Header

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about CAS 24398-88-7, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    CAS 24398-88-7

    Manufacturers/Suppliers

    PharmaCompass

    Naprod is a top player in Oncology & Anesthesia FDF through excellent innovation, discovery of new processes & high-quality production.

    Skyepharma, an Expert and Innovative CDMO Partner for tailor-made solutions in complex oral solids and bioproduction.

    2D Structure
    1. Also known as: 24398-88-7, 3-bromobenzoic acid ethyl ester, Ethyl-3-bromobenzoate, Benzoic acid, 3-bromo-, ethyl ester, Benzoic acid, m-bromo-, ethyl ester, Mfcd00013529
    Molecular Formula
    C9H9BrO2
    Molecular Weight
    229.07  g/mol
    InChI Key
    QAUASTLEZAPQTB-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    ethyl 3-bromobenzoate
    2.1.2 InChI
    InChI=1S/C9H9BrO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3
    2.1.3 InChI Key
    QAUASTLEZAPQTB-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCOC(=O)C1=CC(=CC=C1)Br
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 24398-88-7

    2. 3-bromobenzoic Acid Ethyl Ester

    3. Ethyl-3-bromobenzoate

    4. Benzoic Acid, 3-bromo-, Ethyl Ester

    5. Benzoic Acid, M-bromo-, Ethyl Ester

    6. Mfcd00013529

    7. M-bromobenzoic Acid, Ethyl Ester

    8. Einecs 246-223-9

    9. Ethyl 3-bromobenzoate, 98%

    10. Schembl245137

    11. 3-(ethoxycarbonyl)phenyl Bromide

    12. Qauastlezapqtb-uhfffaoysa-

    13. 3-bromo-benzoic Acid Ethyl Ester

    14. 3-bromobenzoic Acid, Ethyl Ester

    15. Dtxsid40179143

    16. Zinc389583

    17. Act08394

    18. Amy18049

    19. Str07102

    20. Ab7142

    21. Akos000266440

    22. Cs-w012982

    23. Sy009069

    24. Db-002717

    25. A5029

    26. Ft-0615204

    27. Ft-0625756

    28. Ft-0626020

    29. W-107320

    30. Q63398868

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 229.07 g/mol
    Molecular Formula C9H9BrO2
    XLogP33.2
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass227.97859 g/mol
    Monoisotopic Mass227.97859 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity159
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    Post Enquiry
    POST ENQUIRY