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    Technical details about CAS 2252-50-8, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 2252-50-8

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    PharmaCompass

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

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    2D Structure
    1. Also known as: 2252-50-8, 2-chloro-5-fluorobenzoicacid, 2-chloro-5-fluoro-benzoic acid, 2-chloro-5-fluoro benzoic acid, Mfcd00156967, 5-fluoro-2-chlorobenzoic acid
    Molecular Formula
    C7H4ClFO2
    Molecular Weight
    174.55  g/mol
    InChI Key
    MIZKCMSSYVUZKD-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-chloro-5-fluorobenzoic acid
    2.1.2 InChI
    InChI=1S/C7H4ClFO2/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3H,(H,10,11)
    2.1.3 InChI Key
    MIZKCMSSYVUZKD-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C(C=C1F)C(=O)O)Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 2252-50-8

    2. 2-chloro-5-fluorobenzoicacid

    3. 2-chloro-5-fluoro-benzoic Acid

    4. 2-chloro-5-fluoro Benzoic Acid

    5. Mfcd00156967

    6. 5-fluoro-2-chlorobenzoic Acid

    7. Nsc190631

    8. 2-chloro5-fluorobenzoic Acid

    9. Schembl786240

    10. Dtxsid40307282

    11. Act11974

    12. Zinc1732233

    13. Stk802600

    14. Akos005259289

    15. Ab04161

    16. Ac-3929

    17. Am62233

    18. Bs-3947

    19. Cs-w002454

    20. Nsc 190631

    21. Nsc-190631

    22. Ncgc00330744-01

    23. Sy019215

    24. 2-chloro-5-fluorobenzoic Acid, Aldrichcpr

    25. Db-011388

    26. A4822

    27. Ft-0634168

    28. Ab01325247-02

    29. Z1741959397

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 174.55 g/mol
    Molecular Formula C7H4ClFO2
    XLogP32.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass173.9883852 g/mol
    Monoisotopic Mass173.9883852 g/mol
    Topological Polar Surface Area37.3 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity163
    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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