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    Technical details about CAS 6850-28-8, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 6850-28-8

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    2D Structure
    1. Also known as: 6850-28-8, Tris acetate, Tris-acetate, Trizma acetate, Tris(hydroxymethyl)aminomethane acetate salt, 2-amino-2-(hydroxymethyl)propane-1,3-diol acetate salt
    Molecular Formula
    C6H15NO5
    Molecular Weight
    181.19  g/mol
    InChI Key
    PIEPQKCYPFFYMG-UHFFFAOYSA-N
    FDA UNII
    YYB8UMN69X
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    acetic acid;2-amino-2-(hydroxymethyl)propane-1,3-diol
    2.1.2 InChI
    InChI=1S/C4H11NO3.C2H4O2/c5-4(1-6,2-7)3-8;1-2(3)4/h6-8H,1-3,5H2;1H3,(H,3,4)
    2.1.3 InChI Key
    PIEPQKCYPFFYMG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(=O)O.C(C(CO)(CO)N)O
    2.2 Other Identifiers
    2.2.1 UNII
    YYB8UMN69X
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 6850-28-8

    2. Tris Acetate

    3. Tris-acetate

    4. Trizma Acetate

    5. Tris(hydroxymethyl)aminomethane Acetate Salt

    6. 2-amino-2-(hydroxymethyl)propane-1,3-diol Acetate Salt

    7. Tris Acetate Salt

    8. 1,3-propanediol, 2-amino-2-(hydroxymethyl)-, Acetate (salt)

    9. Acetic Acid;2-amino-2-(hydroxymethyl)propane-1,3-diol

    10. 2-amino-2-(hydroxymethyl)propane-1,3-diol Acetate

    11. Tris/acetate

    12. Trizma(r) Acetate

    13. Schembl194002

    14. Trimethylolaminomethane Acetate

    15. Chebi:66869

    16. Mfcd00038951

    17. Tris(hydroxymethyl)aminomethaneacetate

    18. Akos016002242

    19. Tris(hydroxymethylamino)methane Acetate

    20. Tris-(hydroxymethyl) Aminomethane Acetate

    21. As-15233

    22. Db-017570

    23. Trizma(r) Acetate, >=99.0% (titration)

    24. Cs-0015190

    25. Ft-0636274

    26. T3294

    27. F20305

    28. 2-amino-2-hydroxymethyl-1,3-propanediol Acetate

    29. Trizma(r) Acetate, Bioultra, >=99.0% (nt)

    30. 2-amino-2-(hydroxymethyl)-1,3-propanediol Acetate

    31. Trizma(r) Acetate, Vetec(tm) Reagent Grade, 99%

    32. W-104667

    33. (6-tert-butoxycarbonylamino-pyridin-2-yl)-aceticacid

    34. 2-amino-2-(hydroxymethyl)propane-1,3-diolacetatesalt

    35. Q27135481

    36. 1,3-dihydroxy-2-(hydroxymethyl)propan-2-aminium Acetate

    37. 1,3-propanediol, 2-amino-2-(hydroxymethyl)-, Acetate

    2.4 Create Date
    2007-07-16
    3 Chemical and Physical Properties
    Molecular Weight 181.19 g/mol
    Molecular Formula C6H15NO5
    Hydrogen Bond Donor Count5
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count3
    Exact Mass181.09502258 g/mol
    Monoisotopic Mass181.09502258 g/mol
    Topological Polar Surface Area124 Ų
    Heavy Atom Count12
    Formal Charge0
    Complexity85.1
    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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