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    Technical details about CAS 40172-95-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS-40172-95-0

    BUILDING BLOCK

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    2D Structure
    Also known as: 40172-95-0, Furan-2-yl(piperazin-1-yl)methanone, N-(2-furoyl)piperazine, 1-(2-furoyl)-piperazine, 1-(furan-2-carbonyl)piperazine, Piperazine, 1-(2-furanylcarbonyl)-
    Molecular Formula
    C9H12N2O2
    Molecular Weight
    180.20  g/mol
    InChI Key
    SADPINFEWFPMEA-UHFFFAOYSA-N
    FDA UNII
    8AUX72LL1P
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    furan-2-yl(piperazin-1-yl)methanone
    2.1.2 InChI
    InChI=1S/C9H12N2O2/c12-9(8-2-1-7-13-8)11-5-3-10-4-6-11/h1-2,7,10H,3-6H2
    2.1.3 InChI Key
    SADPINFEWFPMEA-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CN(CCN1)C(=O)C2=CC=CO2
    2.2 Other Identifiers
    2.2.1 UNII
    8AUX72LL1P
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 40172-95-0

    2. Furan-2-yl(piperazin-1-yl)methanone

    3. N-(2-furoyl)piperazine

    4. 1-(2-furoyl)-piperazine

    5. 1-(furan-2-carbonyl)piperazine

    6. Piperazine, 1-(2-furanylcarbonyl)-

    7. 1-(furan-2-ylcarbonyl)piperazine

    8. N-(2-furoyl) Piperazine

    9. Mfcd00038831

    10. (furan-2-yl)(piperazin-1-yl)methanone

    11. 8aux72ll1p

    12. 2-furanyl-1-piperazinylmethanone

    13. Furan-2-yl-piperazin-1-yl-methanone

    14. Chemdiv2_000230

    15. Unii-8aux72ll1p

    16. Furoylpiperazine

    17. N-furoylpiperazine

    18. 1-furoylpiperazine

    19. N-furoyl Piperazine

    20. 2-furoyl Piperazine

    21. Einecs 254-823-7

    22. 2-furoic Piperazide

    23. Terazosin Impurity L

    24. N-2-furoyl Piperazine

    25. Prazosin Ep Impurity D

    26. 2-furylpiperazino Ketone

    27. 2-(2-furoyl)piperazine

    28. Dsstox_cid_31524

    29. Dsstox_rid_97409

    30. Dsstox_gsid_57735

    31. Oprea1_198664

    32. Schembl28752

    33. 1-(2-furylcarbonyl)piperazine

    34. Chembl3560648

    35. Dtxsid7057735

    36. 1-(2-furoyl)piperazine, 97%

    37. Hms1369k10

    38. Zinc236148

    39. 1-(2-furanyl Carbonyl) Piperazine

    40. N-(furan-2-oyl)piperazine

    41. 1-(furan-2-yl-methanoyl)piperazine

    42. Tox21_113787

    43. 1-[(furan-2-yl)carbonyl]piperazine

    44. Stk324579

    45. Akos000264123

    46. Fs-1231

    47. Sb61034

    48. Sdccgmls-0065725.p001

    49. Ncgc00253662-01

    50. Bp-13003

    51. Cas-40172-95-0

    52. Db-005583

    53. A6716

    54. Eu-0033740

    55. Ft-0601276

    56. Prazosin Related Compound D [usp-rs]

    57. H10776

    58. Ab00123261-02

    59. Ak-968/40153077

    60. Sr-01000391623

    61. Sr-01000391623-1

    62. W-106385

    63. 1-pentanonmethanone, 2-furanyl-1-piperazinyl-

    64. Prazosin Hydrochloride Impurity D [ep Impurity]

    65. Q27270123

    66. F0266-0467

    67. Terazosin Hydrochloride Dihydrate Impurity L [ep Impurity]

    68. Terazosin Impurity L, European Pharmacopoeia (ep) Reference Standard

    69. N-(2-furancarbonyl)piperazine; Prazosin Bp Impurity D; Terazosin Ep Impurity L; 1-(furan-2-ylcarbonyl)piperazine; 2-furanyl-1-piperazinylmethanone

    2.4 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 180.20 g/mol
    Molecular Formula C9H12N2O2
    XLogP30.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass180.089877630 g/mol
    Monoisotopic Mass180.089877630 g/mol
    Topological Polar Surface Area45.5 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity190
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1