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    Technical details about 81282-60-2, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
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    81282-60-2

    Manufacturers/Suppliers

    PharmaCompass

    Symbiotec: Global API manufacturer, specializing in Cortico-Steroids & Steroid-Hormone APIs.

    Metrochem has been delivering customized volume & quality products to customers across the world, taking utmost care of their needs.

    2D Structure
    1. Also known as: 81282-60-2, 7-aminobenzo[d]oxazol-2(3h)-one, 7-amino-3h-1,3-benzoxazol-2-one, 7-aminobenzoxazol-2(3h)-one, 2(3h)-benzoxazolone, 7-amino-, 7-amino-3h-benzooxazol-2-one
    Molecular Formula
    C7H6N2O2
    Molecular Weight
    150.13  g/mol
    InChI Key
    CLCPWTXGFUIRJE-UHFFFAOYSA-N
    FDA UNII
    4735Y92350
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    7-amino-3H-1,3-benzoxazol-2-one
    2.1.2 InChI
    InChI=1S/C7H6N2O2/c8-4-2-1-3-5-6(4)11-7(10)9-5/h1-3H,8H2,(H,9,10)
    2.1.3 InChI Key
    CLCPWTXGFUIRJE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=C2C(=C1)NC(=O)O2)N
    2.2 Other Identifiers
    2.2.1 UNII
    4735Y92350
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 81282-60-2

    2. 7-aminobenzo[d]oxazol-2(3h)-one

    3. 7-amino-3h-1,3-benzoxazol-2-one

    4. 7-aminobenzoxazol-2(3h)-one

    5. 2(3h)-benzoxazolone, 7-amino-

    6. 7-amino-3h-benzooxazol-2-one

    7. Mfcd09753616

    8. 7-amino-1,3-benzoxazol-2(3h)-one

    9. 4735y92350

    10. 7-amino-2-benzoxazolinone

    11. Unii-4735y92350

    12. 7-amino-2-benzoxazolone

    13. 7-amino-2,3-dihydro-1,3-benzoxazol-2-one

    14. 7-amino-2-hydroxybenzoxazole

    15. 7-aminobenzo[d]oxazol-2-ol

    16. Schembl1250234

    17. Dtxsid80231037

    18. 7-amino-2-hydroxybenzo[d]oxazole

    19. Clcpwtxgfuirje-uhfffaoysa-n

    20. Akos006327730

    21. Pb48717

    22. Ac-30142

    23. Sy055244

    24. A9989

    25. Bb 0305923

    26. Cs-0089315

    27. Ft-0661587

    28. En300-110287

    29. Q27258997

    30. Z1198223473

    2.4 Create Date
    2006-10-26
    3 Chemical and Physical Properties
    Molecular Weight 150.13 g/mol
    Molecular Formula C7H6N2O2
    XLogP30.5
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area64.4
    Heavy Atom Count11
    Formal Charge0
    Complexity183
    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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