Cas no 2460486-67-1 (piperidin-2,2,3,4,5,5,6-d7-3-ol)

piperidin-2,2,3,4,5,5,6-d7-3-ol structure
2460486-67-1 structure
Product Name:piperidin-2,2,3,4,5,5,6-d7-3-ol
CAS No:2460486-67-1
MF:C5H11NO
MW:108.190073251724
CID:6825788
PubChem ID:172406498
Update Time:2025-02-28

piperidin-2,2,3,4,5,5,6-d7-3-ol Chemical and Physical Properties

Names and Identifiers

    • piperidin-2,2,3,4,5,5,6-d7-3-ol
    • 2460486-67-1
    • CS-23939
    • Inchi: 1S/C5H11NO/c7-5-2-1-3-6-4-5/h5-7H,1-4H2/i1D2,2D,3D,4D2,5D
    • InChI Key: BIWOSRSKDCZIFM-XCAPKYJESA-N
    • SMILES: OC1([2H])C([2H])([2H])NC([2H])C([2H])([2H])C1[2H]

Computed Properties

  • Exact Mass: 108.128001196Da
  • Monoisotopic Mass: 108.128001196Da
  • Isotope Atom Count: 7
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 0
  • Complexity: 56
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.3
  • Topological Polar Surface Area: 32.3?2
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