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    Technical details about CAS 22795-99-9, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 22795-99-9

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    2D Structure
    Also known as: 22795-99-9, (s)-(1-ethylpyrrolidin-2-yl)methanamine, (s)-2-(aminomethyl)-1-ethylpyrrolidine, [(2s)-1-ethylpyrrolidin-2-yl]methanamine, (s)-1-ethyl-2-aminomethylpyrrolidine, (2s)-2-aminomethyl-1-ethylpyrrolidine
    Molecular Formula
    C7H16N2
    Molecular Weight
    128.22  g/mol
    InChI Key
    UNRBEYYLYRXYCG-ZETCQYMHSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(2S)-1-ethylpyrrolidin-2-yl]methanamine
    2.1.2 InChI
    InChI=1S/C7H16N2/c1-2-9-5-3-4-7(9)6-8/h7H,2-6,8H2,1H3/t7-/m0/s1
    2.1.3 InChI Key
    UNRBEYYLYRXYCG-ZETCQYMHSA-N
    2.1.4 Canonical SMILES
    CCN1CCCC1CN
    2.1.5 Isomeric SMILES
    CCN1CCC[C@H]1CN
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 22795-99-9

    2. (s)-(1-ethylpyrrolidin-2-yl)methanamine

    3. (s)-2-(aminomethyl)-1-ethylpyrrolidine

    4. [(2s)-1-ethylpyrrolidin-2-yl]methanamine

    5. (s)-1-ethyl-2-aminomethylpyrrolidine

    6. (2s)-2-aminomethyl-1-ethylpyrrolidine

    7. 2-pyrrolidinemethanamine, 1-ethyl-, (2s)-

    8. (s)-(-)-2-(aminomethyl)-1-ethylpyrrolidine

    9. Mfcd00191371

    10. (s)-(-)-2-(aminomethyl)-1-ethylpyrrolidine, 98%

    11. C7h16n2

    12. (s)-2-aminomethyl-1-ethylpyrrolidine

    13. (-)-1-ethyl-2-(aminomethyl)pyrrolidine

    14. Schembl335433

    15. Dtxsid20349185

    16. Zinc19230162

    17. Akos015854574

    18. Cs-w002498

    19. (2s)-1-ethylpyrrolidine-2-methanamine

    20. As-13187

    21. (s)-(-)-amino Methyl-1-ethylpyrrolidine

    22. (-)-(s)-2-aminomethyl-1-ethylpyrrolidine

    23. (s)-(-)-1-ethyl-2-aminomethylpyrrolidine

    24. (s)-(_)-2-aminomethyl-1-ethylpyrrolidine

    25. Db-024547

    26. (2s)-(-)-1-ethyl-2-aminomethylpyrrolidine

    27. A1301

    28. A4852

    29. [[(2s)-1-ethylpyrrolidin-2-yl]methyl]amine

    30. 1-[(2s)-1-ethylpyrrolidin-2-yl]methanamine

    31. (s)-(-)-2-aminomethyl-1-ethylpyrrolidine, 96%

    32. 795a999

    2.3 Create Date
    2005-07-09
    3 Chemical and Physical Properties
    Molecular Weight 128.22 g/mol
    Molecular Formula C7H16N2
    XLogP30.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass128.131348519 g/mol
    Monoisotopic Mass128.131348519 g/mol
    Topological Polar Surface Area29.3 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity83
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1