Cas no 20245-84-5 (2,4(1H,3H)-Pyrimidinedione, 1-ethenyl-5-methyl-)

2,4(1H,3H)-Pyrimidinedione, 1-ethenyl-5-methyl- structure
20245-84-5 structure
Product Name:2,4(1H,3H)-Pyrimidinedione, 1-ethenyl-5-methyl-
CAS No:20245-84-5
MF:C7H8N2O2
MW:152.150621414185
CID:1391909
PubChem ID:4652520
Update Time:2025-04-20

2,4(1H,3H)-Pyrimidinedione, 1-ethenyl-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 2,4(1H,3H)-Pyrimidinedione, 1-ethenyl-5-methyl-
    • 1-ethenyl-5-methylpyrimidine-2,4-dione
    • 5-Methyl-1-vinylpyrimidine-2,4(1H,3H)-dione
    • vinyl thymine
    • SR-01000404126
    • AKOS025151117
    • SCHEMBL9190807
    • 1-Vinyl-thymine
    • 20245-84-5
    • SR-01000404126-1
    • Inchi: 1S/C7H8N2O2/c1-3-9-4-5(2)6(10)8-7(9)11/h3-4H,1H2,2H3,(H,8,10,11)
    • InChI Key: JUCQIDYDXCHRKC-UHFFFAOYSA-N
    • SMILES: O=C1C(C)=CN(C=C)C(N1)=O

Computed Properties

  • Exact Mass: 152.05864
  • Monoisotopic Mass: 152.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 255
  • 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
  • Topological Polar Surface Area: 49.4A^2

Experimental Properties

  • PSA: 49.41
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