Cas no 126215-88-1 (Pyrimidine, 5-nitro-2-(4-pentyn-1-yl)-)

Pyrimidine, 5-nitro-2-(4-pentyn-1-yl)- structure
126215-88-1 structure
Product Name:Pyrimidine, 5-nitro-2-(4-pentyn-1-yl)-
CAS No:126215-88-1
MF:C9H9N3O2
MW:191.186661481857
CID:6639947
Update Time:2024-01-19

Pyrimidine, 5-nitro-2-(4-pentyn-1-yl)- Chemical and Physical Properties

Names and Identifiers

    • Pyrimidine, 5-nitro-2-(4-pentyn-1-yl)-
    • Inchi: 1S/C9H9N3O2/c1-2-3-4-5-9-10-6-8(7-11-9)12(13)14/h1,6-7H,3-5H2
    • InChI Key: UDKHKKUOPDHVGG-UHFFFAOYSA-N
    • SMILES: C1(CCCC#C)=NC=C([N+]([O-])=O)C=N1

Experimental Properties

  • Density: 1.242±0.06 g/cm3(Predicted)
  • Boiling Point: 309.0±22.0 °C(Predicted)
  • pka: -1.40±0.22(Predicted)
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