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    Technical details about CAS 4584-49-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS-4584-49-0

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    2D Structure
    Also known as: 4584-49-0, 2-chloro-n,n-dimethylpropan-1-amine hydrochloride, 2-dimethylaminoisopropyl chloride hydrochloride, 2-chloro-1-(dimethylamino)propane hydrochloride, 2-(dimethylamino)isopropyl chloride hydrochloride, 2-chloro-n,n-dimethylpropylamine hydrochloride
    Molecular Formula
    C5H13Cl2N
    Molecular Weight
    158.07  g/mol
    InChI Key
    OCWGRWAYARCRTQ-UHFFFAOYSA-N
    FDA UNII
    AO9WB15SNZ
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-chloro-N,N-dimethylpropan-1-amine;hydrochloride
    2.1.2 InChI
    InChI=1S/C5H12ClN.ClH/c1-5(6)4-7(2)3;/h5H,4H2,1-3H3;1H
    2.1.3 InChI Key
    OCWGRWAYARCRTQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(CN(C)C)Cl.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    AO9WB15SNZ
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 4584-49-0

    2. 2-chloro-n,n-dimethylpropan-1-amine Hydrochloride

    3. 2-dimethylaminoisopropyl Chloride Hydrochloride

    4. 2-chloro-1-(dimethylamino)propane Hydrochloride

    5. 2-(dimethylamino)isopropyl Chloride Hydrochloride

    6. 2-chloro-n,n-dimethylpropylamine Hydrochloride

    7. 2-chloropropyldimethylamine Hydrochloride

    8. (2-chloropropyl)dimethylamine Hydrochloride

    9. 1-methyl-2-dimethylaminoethyl Chloride Hydrochloride

    10. (2-chloropropyl)dimethylamine Monohydrochloride

    11. 1-(dimethylamino)-2-chloropropane Hydrochloride

    12. 2-chloro-n',n'-dimethylaminopropane Hydrochloride

    13. 2-chloropropyl-dimethylamine Hydrochloride

    14. 2-(dimethylamino)-1-methylethyl Chloride Hydrochloride

    15. Ao9wb15snz

    16. 2-chloro-n,n-dimethyl-1-propanamine Hydrochloride

    17. Propylamine, 2-chloro-n,n-dimethyl-, Hydrochloride

    18. 1-propanamine, 2-chloro-n,n-dimethyl-, Hydrochloride

    19. Nsc-5367

    20. Nsc-53532

    21. 1-propanamine, 2-chloro-n,n-dimethyl-, Hydrochloride (1:1)

    22. 2-chloro-n,n-dimethylaminopropane Hydrochloride

    23. 2-chloro-1-dimethylaminopropane Hydrochloride

    24. 2-chloropropyldimethylammonium Chloride

    25. Wln: Gy1&1n1&1 &gh

    26. 1-propanamine,n-dimethyl-, Hydrochloride

    27. Propane,n-dimethylamino)-2-chloro-, Hydrochloride

    28. Nsc 5367

    29. Einecs 224-971-7

    30. Nsc 53532

    31. Ai3-26684

    32. 2-dimethylaminoisopropylchloridehydrochloride

    33. Mfcd00012534

    34. 2-chloro-n,n-dimethylpropylamine Hcl

    35. Propane, 1-(n,n-dimethylamino)-2-chloro-, Hydrochloride

    36. Unii-ao9wb15snz

    37. Dsstox_cid_4780

    38. Dsstox_gsid_24780

    39. Schembl377772

    40. Dtxsid3024780

    41. Nsc5367

    42. Nsc53532

    43. Tox21_303897

    44. Akos015900665

    45. Am90213

    46. Sb76089

    47. Ncgc00357152-01

    48. As-68091

    49. Cas-4584-49-0

    50. Dimethylaminoisopropyl Chloride Hydrochloride

    51. Cs-0128777

    52. D1665

    53. Ft-0611668

    54. 1-dimethylamino-2-propyl Chloride Hydrochloride

    55. 2-chloro-n,n-dimethylpropan-1-aminehydrochloride

    56. 2-chloro-n,n-dimethylpropan-1-amine;hydrochloride

    57. 2-dimethylamino-1-methylethylchloride Hydrochloride

    58. A872329

    59. 2-chloro-n,n-dimethylpropylamine Hydrochloride, 98%

    60. 1-dimethylaminopropan-2-yl Chloride Hydrochloride

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 158.07 g/mol
    Molecular Formula C5H13Cl2N
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass157.0425048 g/mol
    Monoisotopic Mass157.0425048 g/mol
    Topological Polar Surface Area3.2 Ų
    Heavy Atom Count8
    Formal Charge0
    Complexity45.3
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2