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    Also known as: Dl-asparagine hydrate, 3130-87-8, 69833-18-7, 2,4-diamino-4-oxobutanoic acid hydrate, 2,4-diamino-4-oxobutanoic acid;hydrate, D-asparaginemonohydrate
    Molecular Formula
    C4H10N2O4
    Molecular Weight
    150.13  g/mol
    InChI Key
    RBMGJIZCEWRQES-UHFFFAOYSA-N
    L-Asparagine Monohydrate
    1 2D Structure

    L-Asparagine Monohydrate

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2,4-diamino-4-oxobutanoic acid;hydrate
    2.1.2 InChI
    InChI=1S/C4H8N2O3.H2O/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H2,6,7)(H,8,9);1H2
    2.1.3 InChI Key
    RBMGJIZCEWRQES-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C(C(C(=O)O)N)C(=O)N.O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Dl-asparagine Hydrate

    2. 3130-87-8

    3. 69833-18-7

    4. 2,4-diamino-4-oxobutanoic Acid Hydrate

    5. 2,4-diamino-4-oxobutanoic Acid;hydrate

    6. D-asparaginemonohydrate

    7. H-dl-asn-oh

    8. Dl-aspartic Acid 4-amide

    9. Mfcd00151039

    10. Dl-asparagine, Monohydrate

    11. Asparagine, Monohydrate(9ci)

    12. L-asparagine-[amide-15n] Monohydrate

    13. 204451-47-8

    14. D,l-asn.h2o

    15. Schembl50254

    16. Asparagine, D-l-, Monohydrate

    17. L-asparagine-4-13c Monohydrate

    18. Bcp26438

    19. 2,4-diamino-4-oxobutanoicacidhydrate

    20. Akos016001349

    21. (+/-)-2-aminosuccinic Acid 4-amide

    22. Ac-24125

    23. As-12270

    24. Db-015365

    25. Db-048007

    26. Am20090442

    27. Cs-0188414

    28. Dl-asparagine Monohydrate, >=99.0% (nt)

    29. Ft-0609962

    30. Ft-0624454

    31. Ft-0625440

    32. Ft-0627707

    33. En300-71864

    34. A-9020

    35. L-asparagine Hydrate Pound>>l(+)-asparagine Monohydrate

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 150.13 g/mol
    Molecular Formula C4H10N2O4
    Hydrogen Bond Donor Count4
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count3
    Exact Mass150.06405680 g/mol
    Monoisotopic Mass150.06405680 g/mol
    Topological Polar Surface Area107 Ų
    Heavy Atom Count10
    Formal Charge0
    Complexity134
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2

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    API Reference Price

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    29-Apr-2021
    01-Aug-2024
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