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    CAS 57616-74-7

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    CAS 57616-74-7
    Also known as: 57616-74-7, 4-(3-chloropropyl)morpholinium chloride, 4-(3-chloropropyl)morpholinehcl, 4-(3-chloro-propyl)-morpholine hydrochloride, 4-(3-chloropropyl)morpholine;hydrochloride, 4-(3-chloropropyl)morpholine, hcl
    Molecular Formula
    C7H15Cl2NO
    Molecular Weight
    200.10  g/mol
    InChI Key
    PQECODMSWJOUAT-UHFFFAOYSA-N
    1 2D Structure

    CAS 57616-74-7

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-(3-chloropropyl)morpholine;hydrochloride
    2.1.2 InChI
    InChI=1S/C7H14ClNO.ClH/c8-2-1-3-9-4-6-10-7-5-9;/h1-7H2;1H
    2.1.3 InChI Key
    PQECODMSWJOUAT-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1COCCN1CCCCl.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 57616-74-7

    2. 4-(3-chloropropyl)morpholinium Chloride

    3. 4-(3-chloropropyl)morpholinehcl

    4. 4-(3-chloro-propyl)-morpholine Hydrochloride

    5. 4-(3-chloropropyl)morpholine;hydrochloride

    6. 4-(3-chloropropyl)morpholine, Hcl

    7. N-(3-chloropropyl)morpholine Hydrochloride

    8. 4-(3-chloropropyl)-morpholine Hydrochloride

    9. Morpholine, 4-(3-chloropropyl)-, Hydrochloride

    10. Einecs 260-851-0

    11. 4-(3-chloropropyl);morpholine Hydrochloride

    12. Schembl10978

    13. Dtxsid40206281

    14. Amy33765

    15. Mfcd00035333

    16. 3-chloropropylmorpholine Hydrochloride

    17. 4-(3-chloropropyl)morpholiniumchloride

    18. Akos015899574

    19. 4-(3-chloroprop-1-yl)morpholine Hcl

    20. H57c677

    21. Sb17605

    22. 4-(3-chloropropyl)morpholinehydrochloride

    23. As-37275

    24. 3-morpholino-1-chloropropane Hydrochloride

    25. 4-(3-chloropropyl) Morpholine Hydrochloride

    26. N-(3-chloropropyl) Morpholine Hydrochloride

    27. 4-(3-chloro-propyl)-morpholine Hydrocloride

    28. Cs-0051203

    29. Ft-0615297

    30. En300-62064

    31. 4-(3-chloropropyl)morpholine Hydrochloride, 97%

    32. 4-(3-chloropropyl)morpholine Hydrochloride, 99%

    33. 616c747

    34. A869631

    35. F2108-0002

    2.3 Create Date
    2007-02-07
    3 Chemical and Physical Properties
    Molecular Weight 200.10 g/mol
    Molecular Formula C7H15Cl2NO
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass199.0530695 g/mol
    Monoisotopic Mass199.0530695 g/mol
    Topological Polar Surface Area12.5 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity83.7
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
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