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    CAS 212248-62-9

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    CAS 212248-62-9
    Also known as: 144035-22-3, 212248-62-9, 1-[(4-hydrazinylphenyl)methyl]-1h-1,2,4-triazole, [4-(1,2,4-triazol-1-ylmethyl)phenyl]hydrazine, 1-(4-hydrazinophenyl)methyl-1,2,4-triazole, 1-(4-hydrazinobenzyl)-1h-1,2,4-triazole
    Molecular Formula
    C9H11N5
    Molecular Weight
    189.22  g/mol
    InChI Key
    FUJKUTJPEGEMHG-UHFFFAOYSA-N
    FDA UNII
    335U9MFY9M
    1 2D Structure

    CAS 212248-62-9

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [4-(1,2,4-triazol-1-ylmethyl)phenyl]hydrazine
    2.1.2 InChI
    InChI=1S/C9H11N5/c10-13-9-3-1-8(2-4-9)5-14-7-11-6-12-14/h1-4,6-7,13H,5,10H2
    2.1.3 InChI Key
    FUJKUTJPEGEMHG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC(=CC=C1CN2C=NC=N2)NN
    2.2 Other Identifiers
    2.2.1 UNII
    335U9MFY9M
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 144035-22-3

    2. 212248-62-9

    3. 1-[(4-hydrazinylphenyl)methyl]-1h-1,2,4-triazole

    4. [4-(1,2,4-triazol-1-ylmethyl)phenyl]hydrazine

    5. 1-(4-hydrazinophenyl)methyl-1,2,4-triazole

    6. 1-(4-hydrazinobenzyl)-1h-1,2,4-triazole

    7. 335u9mfy9m

    8. 1-((4-hydrazinylphenyl)methyl)-1h-1,2,4-triazole

    9. 1h-1,2,4-triazole, 1-((4-hydrazinylphenyl)methyl)-

    10. 1h-1,2,4-triazole, 1-[(4-hydrazinylphenyl)methyl]-

    11. (1h-1-[(4-hydrazinophenyl)-methyl]-1,2,4-triazole Dihydrochloride

    12. 4-[(1,2,4-triazol-1-yl)methyl]phenylhydrazine Dihydrochloride

    13. Unii-335u9mfy9m

    14. 1h-1,2,4-triazole, 1-[(4-hydrazinophenyl)methyl]-

    15. Schembl4555632

    16. Zinc5046713

    17. Akos006292887

    18. Ac-3465

    19. Db-063512

    20. Db-066454

    21. Ft-0669259

    22. Ft-0719996

    23. 4-(1,2,4-triazol-1-ylmethyl)phenylhydrazine

    24. 4-(1,2,4-triazol-1-ylmethyl)phenyl Hydrazine

    25. D91037

    26. 248h629

    27. Ar-011/42531524

    28. J-007904

    2.4 Create Date
    2006-07-29
    3 Chemical and Physical Properties
    Molecular Weight 189.22 g/mol
    Molecular Formula C9H11N5
    XLogP30.2
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count3
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area68.8
    Heavy Atom Count14
    Formal Charge0
    Complexity167
    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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