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    Technical details about 534-03-2, learn more about the structure, uses, toxicity, action, side effects and more

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    534-03-2

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    2D Structure
    1. Also known as: 534-03-2, Serinol, 2-aminopropane-1,3-diol, 1,3-propanediol, 2-amino-, 2-amino-1,3-propandiol, 2-amino-1,3-dihydroxypropane
    Molecular Formula
    C3H9NO2
    Molecular Weight
    91.11  g/mol
    InChI Key
    KJJPLEZQSCZCKE-UHFFFAOYSA-N
    FDA UNII
    IC94L30J8M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-aminopropane-1,3-diol
    2.1.2 InChI
    InChI=1S/C3H9NO2/c4-3(1-5)2-6/h3,5-6H,1-2,4H2
    2.1.3 InChI Key
    KJJPLEZQSCZCKE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C(C(CO)N)O
    2.2 Other Identifiers
    2.2.1 UNII
    IC94L30J8M
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 2-aminopropane-1,3-diol

    2. Serinol

    3. Serinol, (+-)-isomer

    2.3.2 Depositor-Supplied Synonyms

    1. 534-03-2

    2. Serinol

    3. 2-aminopropane-1,3-diol

    4. 1,3-propanediol, 2-amino-

    5. 2-amino-1,3-propandiol

    6. 2-amino-1,3-dihydroxypropane

    7. Einecs 208-584-0

    8. Unii-ic94l30j8m

    9. Ic94l30j8m

    10. Nsc-93746

    11. Ec 208-584-0

    12. 2-aminopropan-1,3-diol

    13. Dl-serinol

    14. Mfcd00051487

    15. Serinol, 98%

    16. 2-amino-propane-1,3-diol

    17. 1,3-dihydroxy-2-propylamine

    18. Chembl116834

    19. Dtxsid2060202

    20. 1,3-dihydroxyisopropylamine

    21. Bcp04588

    22. Nsc93746

    23. Str04075

    24. 2-hydroxy-1-hydroxymethyl-ethylamine

    25. Nsc 93746

    26. Stl185545

    27. Akos006222776

    28. Bcp9000083

    29. Cs-w007357

    30. Sb83775

    31. [2-hydroxy-1-(hydroxymethyl)ethyl]amine

    32. Ac-13723

    33. Bp-10859

    34. Sel

    35. Bcp0726000041

    36. A1252

    37. Am20100310

    38. Ft-0601229

    39. 2-hydroxy-1-(hydroxymethyl)ethylamine

    40. En300-84186

    41. F10927

    42. W-105738

    43. Q16068659

    44. F1905-7141

    45. Z1203577940

    46. Inchi=1/c3h9no2/c4-3(1-5)2-6/h3,5-6h,1-2,4h

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 91.11 g/mol
    Molecular Formula C3H9NO2
    XLogP3-2
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area66.5
    Heavy Atom Count6
    Formal Charge0
    Complexity28
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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