Cas no 1643576-94-6 (3-Bromo-6-(pyrrolidino)pyridine-d11)

3-Bromo-6-(pyrrolidino)pyridine-d11 structure
1643576-94-6 structure
Product Name:3-Bromo-6-(pyrrolidino)pyridine-d11
CAS No:1643576-94-6
MF:C9H11BrN2
MW:238.168819665909
CID:6810529
PubChem ID:133554486
Update Time:2025-03-06

3-Bromo-6-(pyrrolidino)pyridine-d11 Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-6-(pyrrolidino)pyridine-d11
    • 1643576-94-6
    • CS-19863
    • Inchi: 1S/C9H11BrN2/c10-8-3-4-9(11-7-8)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2/i1D2,2D2,3D,4D,5D2,6D2,7D
    • InChI Key: MEVCTGBLQDZPFZ-OIQATLFCSA-N
    • SMILES: BrC1=C([2H])N=C(C([2H])=C1[2H])N1C([2H])([2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]

Computed Properties

  • Exact Mass: 237.07961Da
  • Monoisotopic Mass: 237.07961Da
  • Isotope Atom Count: 11
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 145
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 16.1?2

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