Cas no 62242-40-4 (2(1H)-Pyrimidinone,4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl-)

2(1H)-Pyrimidinone,4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl- structure
62242-40-4 structure
Product Name:2(1H)-Pyrimidinone,4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl-
CAS No:62242-40-4
MF:C12H16N6O2
MW:276.294441223145
CID:452841
Update Time:2024-01-30

2(1H)-Pyrimidinone,4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 2(1H)-Pyrimidinone,4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl-
    • 2(1H)-Pyrimidinone, 4-amino-1-[3-(4-amino-2-oxo-1(2H)-pyrimidinyl)propyl]-5-methyl-
    • Inchi: 1S/C12H16N6O2/c1-8-7-18(12(20)16-10(8)14)5-2-4-17-6-3-9(13)15-11(17)19/h3,6-7H,2,4-5H2,1H3,(H2,13,15,19)(H2,14,16,20)
    • InChI Key: LGLNJIRVQZYWHC-UHFFFAOYSA-N
    • SMILES: C1(=O)N(CCCN2C(=O)N=C(N)C=C2)C=C(C)C(N)=N1

Computed Properties

  • Exact Mass: 276.13368

Experimental Properties

  • Density: 1.47±0.1 g/cm3(Predicted)
  • Boiling Point: 501.8±60.0 °C(Predicted)
  • PSA: 117.38
  • pka: 4.86±0.10(Predicted)
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