Cas no 2460490-24-6 (2-chloro-4-(methyl-d3)pyrimidine-5,6-d2)

2-chloro-4-(methyl-d3)pyrimidine-5,6-d2 structure
2460490-24-6 structure
Product Name:2-chloro-4-(methyl-d3)pyrimidine-5,6-d2
CAS No:2460490-24-6
MF:C5H5ClN2
MW:133.590408086777
CID:6825405
PubChem ID:172403501
Update Time:2025-02-28

2-chloro-4-(methyl-d3)pyrimidine-5,6-d2 Chemical and Physical Properties

Names and Identifiers

    • 2460490-24-6
    • CS-23524
    • 2-chloro-4-(methyl-d3)pyrimidine-5,6-d2
    • Inchi: 1S/C5H5ClN2/c1-4-2-3-7-5(6)8-4/h2-3H,1H3/i1D3,2D,3D
    • InChI Key: BHAKRVSCGILCEW-RHIBPKLGSA-N
    • SMILES: ClC1=NC([2H])=C([2H])C(C([2H])([2H])[2H])=N1

Computed Properties

  • Exact Mass: 133.0455096Da
  • Monoisotopic Mass: 133.0455096Da
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 76.8
  • 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: 1.6
  • Topological Polar Surface Area: 25.8?2
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