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    Technical details about CAS 1490-25-1, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 1490-25-1

    Manufacturers/Suppliers

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 1490-25-1, Methyl 4-chloro-4-oxobutyrate, Methyl 3-(chloroformyl)propionate, 3-(carbomethoxy)propionyl chloride, Methyl 4-chloro-4-oxo-butanoate, Butanoic acid, 4-chloro-4-oxo-, methyl ester
    Molecular Formula
    C5H7ClO3
    Molecular Weight
    150.56  g/mol
    InChI Key
    SRXOJMOGPYFZKC-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl 4-chloro-4-oxobutanoate
    2.1.2 InChI
    InChI=1S/C5H7ClO3/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3
    2.1.3 InChI Key
    SRXOJMOGPYFZKC-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC(=O)CCC(=O)Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1490-25-1

    2. Methyl 4-chloro-4-oxobutyrate

    3. Methyl 3-(chloroformyl)propionate

    4. 3-(carbomethoxy)propionyl Chloride

    5. Methyl 4-chloro-4-oxo-butanoate

    6. Butanoic Acid, 4-chloro-4-oxo-, Methyl Ester

    7. 3-carbomethoxypropionyl Chloride

    8. Methyl 3-(chloroformyl)propanoate

    9. 4-chloro-4-oxobutyric Acid Methyl Ester

    10. 3-(methoxycarbonyl)propanoyl Chloride; 3-(methoxycarbonyl)propionyl Chloride; 3-carbomethoxypropanoyl Chloride; 3-chlorocarbonylpropionic Acid Methyl Ester

    11. Methoxycarbonylpropionyl Chloride

    12. Nsc10757

    13. Einecs 216-077-0

    14. Nsc 10757

    15. 4-chloro-4-oxo-butanoicacimethylester

    16. Carbomethoxypropionyl Chloride

    17. 3-carbomethoxypropionylchloride

    18. Methyl4-chloro-4-oxobutanoate

    19. Schembl124614

    20. Methyl-4-chloro-4-oxobutyrate

    21. (carbomethoxy)propionyl Chloride

    22. 3-carbomethoxy Propionylchloride

    23. 3-carbomethoxypropanoyl Chloride

    24. 3-carbomethoxyproprionyl Chloride

    25. 3-carbometoxy Propionyl Chloride

    26. Dtxsid7061728

    27. Methyl 3-chlorocarbonylpropionate

    28. 3-carbomethoxy-propionyl Chloride

    29. Methyl-4-chloro-4-oxo-butanoate

    30. Beta-carbomethoxypropionyl Chloride

    31. 3-methoxycarbonylpropionyl Chloride

    32. 1,4-dioxo-4-methoxybutyl Chloride

    33. 3-methoxycarbonyl-propanoyl Chloride

    34. Albb-006318

    35. Methyl 3-(chlorocarbonyl)propanoate

    36. Methyl 3-(chlorocarbonyl)propionate

    37. Zinc1712453

    38. Beta-methoxycarbonylpropionyl Chloride

    39. Mfcd00000750

    40. Nsc-10757

    41. Stk503831

    42. Succinic Acid Monomethylester Chloride

    43. 3-(methoxycarbonyl)-propionyl Chloride

    44. Akos000120411

    45. Methyl 4-chloro-4-oxobutyrate, 97%

    46. 4-chloro-4-oxo-butyric Acid Methyl Ester

    47. As-54552

    48. Db-042966

    49. 3-chlorocarbonyl-propionic Acid Methyl Ester

    50. Bb 0241838

    51. Ft-0633604

    52. M2850

    53. S11982

    54. W-108094

    55. Q63399541

    56. F8880-0964

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 150.56 g/mol
    Molecular Formula C5H7ClO3
    XLogP31
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count4
    Exact Mass150.0083718 g/mol
    Monoisotopic Mass150.0083718 g/mol
    Topological Polar Surface Area43.4 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity121
    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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