Cas no 36161-39-4 (6-Methoxy-1-methylpyrimidine-2,4(1H,3H)-dione)

6-Methoxy-1-methylpyrimidine-2,4(1H,3H)-dione structure
36161-39-4 structure
Product Name:6-Methoxy-1-methylpyrimidine-2,4(1H,3H)-dione
CAS No:36161-39-4
MF:C6H8N2O3
MW:156.139321327209
CID:2823831
PubChem ID:13841872
Update Time:2025-04-21

6-Methoxy-1-methylpyrimidine-2,4(1H,3H)-dione Chemical and Physical Properties

Names and Identifiers

    • 6-Methoxy-1-methylpyrimidine-2,4(1H,3H)-dione
    • 2,4(1H,3H)-Pyrimidinedione, 6-methoxy-1-methyl-
    • F88669
    • 36161-39-4
    • DTXSID40551041
    • 6-METHOXY-1-METHYL-3H-PYRIMIDINE-2,4-DIONE
    • 6-METHOXY-1-METHYL-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONE
    • DB-091134
    • Inchi: 1S/C6H8N2O3/c1-8-5(11-2)3-4(9)7-6(8)10/h3H,1-2H3,(H,7,9,10)
    • InChI Key: GDDJFARLEAKCEM-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC(NC(N1C)=O)=O

Computed Properties

  • Exact Mass: 156.05349212g/mol
  • Monoisotopic Mass: 156.05349212g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 234
  • 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: -0.6
  • Topological Polar Surface Area: 58.6?2

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