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    Also known as: 1171331-39-7, 2-amino-n-(2,2,2-trifluoroethyl)acetamide;hydrochloride, Mfcd12197070, 2-amino-n-(2,2,2-trifluoroethyl)acetamide hcl, 2-amino-n-(2,2,2-trifluoroethyl)acetamidehydrochloride, Ec 806-518-0
    Molecular Formula
    C4H8ClF3N2O
    Molecular Weight
    192.57  g/mol
    InChI Key
    DBNFKWRZLGVLSH-UHFFFAOYSA-N
    CAS 1171331-39-7
    1 2D Structure

    CAS 1171331-39-7

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-amino-N-(2,2,2-trifluoroethyl)acetamide;hydrochloride
    2.1.2 InChI
    InChI=1S/C4H7F3N2O.ClH/c5-4(6,7)2-9-3(10)1-8;/h1-2,8H2,(H,9,10);1H
    2.1.3 InChI Key
    DBNFKWRZLGVLSH-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C(C(=O)NCC(F)(F)F)N.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1171331-39-7

    2. 2-amino-n-(2,2,2-trifluoroethyl)acetamide;hydrochloride

    3. Mfcd12197070

    4. 2-amino-n-(2,2,2-trifluoroethyl)acetamide Hcl

    5. 2-amino-n-(2,2,2-trifluoroethyl)acetamidehydrochloride

    6. Ec 806-518-0

    7. Schembl1289973

    8. 2-amino-n-(2,2,2-trifluoroethyl)acetamide Hydrochloride (1:1)

    9. Amy37883

    10. Wwb33139

    11. Akos008013808

    12. Ds-9384

    13. Sb30984

    14. Sy121034

    15. Cs-0136950

    16. En300-44082

    17. C71549

    18. 2-amino-n-(2,2,2-trifluoroethyl) Acetamide Hydrochloride

    19. 2-amino-n-(2,2,2-trifluoroethyl)acetamide Hydrochloride, Aldrichcpr

    20. Acetamide, 2-amino-n-(2,2,2-trifluoroethyl)-, Hydrochloride (1:1)

    2.3 Create Date
    2009-07-20
    3 Chemical and Physical Properties
    Molecular Weight 192.57 g/mol
    Molecular Formula C4H8ClF3N2O
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count2
    Exact Mass192.0277251 g/mol
    Monoisotopic Mass192.0277251 g/mol
    Topological Polar Surface Area55.1 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity122
    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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