loader
Please Wait
Applying Filters...

Minakem Generic APIs Minakem Generic APIs

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about CAS 1300690-48-5, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    CAS 1300690-48-5

    Manufacturers/Suppliers

    PharmaCompass

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

    Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

    2D Structure
    1. Also known as: 1300690-48-5, Ap-24600, Ap24600, 3-(2-{imidazo[1,2-b]pyridazin-3-yl}ethynyl)-4-methylbenzoic acid, 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid, 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid
    Molecular Formula
    C16H11N3O2
    Molecular Weight
    277.28  g/mol
    InChI Key
    SCMPXDBRMCTALZ-UHFFFAOYSA-N
    FDA UNII
    OZ477A282R
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid
    2.1.2 InChI
    InChI=1S/C16H11N3O2/c1-11-4-5-13(16(20)21)9-12(11)6-7-14-10-17-15-3-2-8-18-19(14)15/h2-5,8-10H,1H3,(H,20,21)
    2.1.3 InChI Key
    SCMPXDBRMCTALZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=C(C=C(C=C1)C(=O)O)C#CC2=CN=C3N2N=CC=C3
    2.2 Other Identifiers
    2.2.1 UNII
    OZ477A282R
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1300690-48-5

    2. Ap-24600

    3. Ap24600

    4. 3-(2-{imidazo[1,2-b]pyridazin-3-yl}ethynyl)-4-methylbenzoic Acid

    5. 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic Acid

    6. 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic Acid

    7. Oz477a282r

    8. Mfcd27980055

    9. Benzoic Acid, 3-(2-imidazo(1,2-b)pyridazin-3-ylethynyl)-4-methyl-

    10. Benzoic Acid, 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-

    11. Unii-oz477a282r

    12. Schembl589881

    13. Amy40099

    14. Bcp29605

    15. Nsc804635

    16. Zinc114164955

    17. Hy-w059917

    18. Nsc-804635

    19. Sb17753

    20. As-52045

    21. Da-12847

    22. Sy099618

    23. Cs-0051771

    24. Ft-0715299

    25. P14225

    26. A854963

    27. Q27285925

    28. 3-(3-imidazo[1,2-b]pyridazinylethynyl)-4-methylbenzoic Acid

    29. 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoicacid

    30. 3-((imidazo(1,2-b)pyridazin-3-yl)ethynyl)-4-methylbenzoic Acid

    31. Ap24600;3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-benzoic Acid Pound>>benzoic Acid, 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-

    2.4 Create Date
    2012-08-19
    3 Chemical and Physical Properties
    Molecular Weight 277.28 g/mol
    Molecular Formula C16H11N3O2
    XLogP32.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass277.085126602 g/mol
    Monoisotopic Mass277.085126602 g/mol
    Topological Polar Surface Area67.5 Ų
    Heavy Atom Count21
    Formal Charge0
    Complexity467
    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