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    Technical details about CAS 1218935-60-4, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 1218935-60-4

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    2D Structure
    1. Also known as: 1218935-60-4, Gq2kxx5u2n, (r)-2-(2,5-difluorophenyl)pyrrolidine hcl, Pyrrolidine, 2-(2,5-difluorophenyl)-, hydrochloride (1:1), (2r)-, (2r)-2-(2,5-difluorophenyl)pyrrolidine;hydrochloride, (2r)-2-(2,5-difluorophenyl)pyrrolidine hydrochloride
    Molecular Formula
    C10H12ClF2N
    Molecular Weight
    219.66  g/mol
    InChI Key
    XSWCQOVADZHFIJ-HNCPQSOCSA-N
    FDA UNII
    GQ2KXX5U2N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2R)-2-(2,5-difluorophenyl)pyrrolidine;hydrochloride
    2.1.2 InChI
    InChI=1S/C10H11F2N.ClH/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;/h3-4,6,10,13H,1-2,5H2;1H/t10-;/m1./s1
    2.1.3 InChI Key
    XSWCQOVADZHFIJ-HNCPQSOCSA-N
    2.1.4 Canonical SMILES
    C1CC(NC1)C2=C(C=CC(=C2)F)F.Cl
    2.1.5 Isomeric SMILES
    C1C[C@@H](NC1)C2=C(C=CC(=C2)F)F.Cl
    2.2 Other Identifiers
    2.2.1 UNII
    GQ2KXX5U2N
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 1218935-60-4

    2. Gq2kxx5u2n

    3. (r)-2-(2,5-difluorophenyl)pyrrolidine Hcl

    4. Pyrrolidine, 2-(2,5-difluorophenyl)-, Hydrochloride (1:1), (2r)-

    5. (2r)-2-(2,5-difluorophenyl)pyrrolidine;hydrochloride

    6. (2r)-2-(2,5-difluorophenyl)pyrrolidine Hydrochloride

    7. 2-(2,5-difluorophenyl)pyrrolidine Hydrochloride, (r)-

    8. Mfcd08751413

    9. Xswcqovadzhfij-hncpqsocsa-n

    10. Unii-gq2kxx5u2n

    11. (2r)-2-(2,5-difluorophenyl)pyrrolidine Hcl

    12. Schembl15017144

    13. Bcp25200

    14. Cs-m3733

    15. Am9006

    16. Akos025395713

    17. Ac-33566

    18. Y10209

    19. A910039

    20. (r)-2-(2,5-difluorophenyl)pyrrolidinehydrochloride

    21. (r)-2-(2,5-difluorophenyl) Pyrrolidine Hydrochloride

    22. (r)-2-(2, 5-difluorophenyl) Pyrrolidine Hydrochloride

    2.4 Create Date
    2015-02-13
    3 Chemical and Physical Properties
    Molecular Weight 219.66 g/mol
    Molecular Formula C10H12ClF2N
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area12
    Heavy Atom Count14
    Formal Charge0
    Complexity174
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
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