Cas no 132332-65-1 (6-chloro-9-cyclobutyl-9H-Purine)

6-chloro-9-cyclobutyl-9H-Purine structure
132332-65-1 structure
Product Name:6-chloro-9-cyclobutyl-9H-Purine
CAS No:132332-65-1
MF:C9H9ClN4
MW:208.64755988121
CID:1104717
PubChem ID:14781911
Update Time:2025-04-20

6-chloro-9-cyclobutyl-9H-Purine Chemical and Physical Properties

Names and Identifiers

    • 6-chloro-9-cyclobutyl-9H-Purine
    • 6-chloro-9-cyclobutylpurine
    • 132332-65-1
    • AMY21230
    • Inchi: 1S/C9H9ClN4/c10-8-7-9(12-4-11-8)14(5-13-7)6-2-1-3-6/h4-6H,1-3H2
    • InChI Key: KQTPEPWLKVESOH-UHFFFAOYSA-N
    • SMILES: ClC1C2=C(N=CN=1)N(C=N2)C1CCC1

Computed Properties

  • Exact Mass: 208.0515740g/mol
  • Monoisotopic Mass: 208.0515740g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 221
  • 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: 0.8
  • Topological Polar Surface Area: 43.6?2
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