Cas no 105556-07-8 (2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(2-oxopropoxy)-)

2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(2-oxopropoxy)- structure
105556-07-8 structure
Product Name:2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(2-oxopropoxy)-
CAS No:105556-07-8
MF:C9H12N2O4
MW:212.202582359314
CID:1156200
Update Time:2024-07-26

2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(2-oxopropoxy)- Chemical and Physical Properties

Names and Identifiers

    • 2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(2-oxopropoxy)-
    • Inchi: 1S/C9H12N2O4/c1-6(12)5-15-8-4-7(13)10(2)9(14)11(8)3/h4H,5H2,1-3H3
    • InChI Key: SNGWFCIGUYKFEQ-UHFFFAOYSA-N
    • SMILES: C1(=O)N(C)C(OCC(=O)C)=CC(=O)N1C

Computed Properties

  • Exact Mass: 212.07976

Experimental Properties

  • Density: 1.30±0.1 g/cm3(Predicted)
  • Melting Point: 124-125 °C(Solv: ethyl acetate (141-78-6))
  • Boiling Point: 338.2±52.0 °C(Predicted)
  • PSA: 66.92
  • pka: -3.14±0.40(Predicted)
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