Cas no 89808-09-3 (5-Pyrimidinol, 2-chloro-4,6-dimethyl-)

5-Pyrimidinol, 2-chloro-4,6-dimethyl- structure
89808-09-3 structure
Product Name:5-Pyrimidinol, 2-chloro-4,6-dimethyl-
CAS No:89808-09-3
MF:C6H7ClN2O
MW:158.58558011055
CID:588646
PubChem ID:13144359
Update Time:2025-04-19

5-Pyrimidinol, 2-chloro-4,6-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 5-Pyrimidinol, 2-chloro-4,6-dimethyl-
    • 2-chloro-4,6-dimethylpyrimidin-5-ol
    • DTXSID80521723
    • SCHEMBL4446227
    • 89808-09-3
    • Inchi: 1S/C6H7ClN2O/c1-3-5(10)4(2)9-6(7)8-3/h10H,1-2H3
    • InChI Key: ZMFHKOIHELTRSB-UHFFFAOYSA-N
    • SMILES: ClC1=NC(C)=C(C(C)=N1)O

Computed Properties

  • Exact Mass: 158.0246905g/mol
  • Monoisotopic Mass: 158.0246905g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 110
  • 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: 46?2
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