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    Technical details about CAS 5271-27-2, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 5271-27-2

    Manufacturers/Suppliers

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    Centrient is a leading manufacturer of Beta-Lactam Antibiotics and a provider of next-generation Statins and Antifungals.

    IKF/Pharmasynthese have been with fine chemicals market and APIs performance for more than 40 years.

    2D Structure
    1. Also known as: 5271-27-2, 1-methyl-3-phenyl-piperazine, 1-methyl-3-phenyl piperazine, 1-n-methyl-3-phenyl-piperazine, Piperazine, 1-methyl-3-phenyl-, (+/-)-3-phenyl-1-methylpiperazine
    Molecular Formula
    C11H16N2
    Molecular Weight
    176.26  g/mol
    InChI Key
    IRMBVBDXXYXPEW-UHFFFAOYSA-N
    FDA UNII
    2ZO535841F
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-methyl-3-phenylpiperazine
    2.1.2 InChI
    InChI=1S/C11H16N2/c1-13-8-7-12-11(9-13)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
    2.1.3 InChI Key
    IRMBVBDXXYXPEW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1CCNC(C1)C2=CC=CC=C2
    2.2 Other Identifiers
    2.2.1 UNII
    2ZO535841F
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 5271-27-2

    2. 1-methyl-3-phenyl-piperazine

    3. 1-methyl-3-phenyl Piperazine

    4. 1-n-methyl-3-phenyl-piperazine

    5. Piperazine, 1-methyl-3-phenyl-

    6. (+/-)-3-phenyl-1-methylpiperazine

    7. 1-methy-3-phenylpiperazine

    8. 3-phenyl-1-methylpiperazine, (+/-)-

    9. Dl-1-methyl-3-phenyl-piperazine

    10. Mfcd03411603

    11. 2zo535841f

    12. Unii-2zo535841f

    13. 1-methyl-3-phenyl-1-piperazine

    14. Ec 431-180-2

    15. N-methyl-3-phenylpiperazine

    16. Schembl90572

    17. Chembl2177127

    18. Dtxsid30967157

    19. Hms1788l18

    20. Albb-006054

    21. Bcp22012

    22. 1-methyl-3-phenylpiperazine, 97%

    23. Stk500650

    24. Akos000266736

    25. Akos016323497

    26. Ab14171

    27. Am85340

    28. Cs-w003047

    29. Fs-1661

    30. Sb46668

    31. Ac-14445

    32. Db-019250

    33. 1-methyl-3-phenylpiperazine 19509-11-6

    34. Ft-0635596

    35. Ft-0658887

    36. M1685

    37. En300-13495

    38. A844449

    39. A905726

    40. Q27255866

    41. 1-methyl-3-phenylpiperazine;1-n-methyl-3-phenyl-piperazine

    2.4 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 176.26 g/mol
    Molecular Formula C11H16N2
    XLogP31.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count1
    Exact Mass176.131348519 g/mol
    Monoisotopic Mass176.131348519 g/mol
    Topological Polar Surface Area15.3 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity152
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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