Cas no 75712-75-3 (5-Chloro-4,6-dimethylpyrimidine)

5-Chloro-4,6-dimethylpyrimidine is a halogenated pyrimidine derivative characterized by its chloro and methyl substituents at the 5, 4, and 6 positions. This compound serves as a versatile intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. Its reactive chloro group enables nucleophilic substitution reactions, while the methyl groups enhance steric and electronic properties, facilitating selective functionalization. The compound’s stability and well-defined reactivity profile make it valuable for constructing complex heterocyclic frameworks. It is typically handled under standard laboratory conditions, with purity and consistency being critical for reproducible results in research and industrial applications.
5-Chloro-4,6-dimethylpyrimidine structure
75712-75-3 structure
Product Name:5-Chloro-4,6-dimethylpyrimidine
CAS No:75712-75-3
MF:C6H7ClN2
MW:142.586179971695
CID:559673
PubChem ID:12600388
Update Time:2025-05-27

5-Chloro-4,6-dimethylpyrimidine Chemical and Physical Properties

Names and Identifiers

    • 5-Chloro-4,6-dimethylpyrimidine
    • Pyrimidine, 5-chloro-4,6-dimethyl- (9CI)
    • DTXSID90503974
    • SCHEMBL3581232
    • 75712-75-3
    • SB56960
    • Inchi: 1S/C6H7ClN2/c1-4-6(7)5(2)9-3-8-4/h3H,1-2H3
    • InChI Key: HOFRUARDOZNMQJ-UHFFFAOYSA-N
    • SMILES: ClC1=C(C)N=CN=C1C

Computed Properties

  • Exact Mass: 142.02991
  • Monoisotopic Mass: 142.0297759g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 87.1
  • 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

Experimental Properties

  • PSA: 25.78

5-Chloro-4,6-dimethylpyrimidine Pricemore >>

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