Cas no 160948-23-2 (1H-Purine-2,8-diamine, 6-(phenylmethoxy)-)

1H-Purine-2,8-diamine, 6-(phenylmethoxy)- structure
160948-23-2 structure
Product Name:1H-Purine-2,8-diamine, 6-(phenylmethoxy)-
CAS No:160948-23-2
MF:C12H12N6O
MW:256.26328086853
CID:1340379
Update Time:2024-08-17

1H-Purine-2,8-diamine, 6-(phenylmethoxy)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Purine-2,8-diamine, 6-(phenylmethoxy)-
    • 9H-Purine-2,8-diamine, 6-(phenylmethoxy)-
    • Inchi: 1S/C12H12N6O/c13-11-15-8-9(16-11)17-12(14)18-10(8)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H5,13,14,15,16,17,18)
    • InChI Key: JFLIIYYCWTUADU-UHFFFAOYSA-N
    • SMILES: N1C2C(=NC(N)=NC=2OCC2=CC=CC=C2)NC=1N

Computed Properties

  • Exact Mass: 256.10746

Experimental Properties

  • Density: 1.60±0.1 g/cm3(Predicted)
  • Boiling Point: 502.5±60.0 °C(Predicted)
  • PSA: 110.38
  • pka: 8.14±0.20(Predicted)
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