Cas no 24114-04-3 (1,1'-(4-methyl-3,5-pyridinediyl)bis-Ethanone)

1,1'-(4-methyl-3,5-pyridinediyl)bis-Ethanone structure
24114-04-3 structure
Product Name:1,1'-(4-methyl-3,5-pyridinediyl)bis-Ethanone
CAS No:24114-04-3
MF:C10H11NO2
MW:177.199842691422
CID:1109611
Update Time:2024-07-25

1,1'-(4-methyl-3,5-pyridinediyl)bis-Ethanone Chemical and Physical Properties

Names and Identifiers

    • 1,1'-(4-methyl-3,5-pyridinediyl)bis-Ethanone
    • Ethanone, 1,1'-(4-methyl-3,5-pyridinediyl)bis-
    • Inchi: 1S/C10H11NO2/c1-6-9(7(2)12)4-11-5-10(6)8(3)13/h4-5H,1-3H3
    • InChI Key: HEKXKUBIELHHIE-UHFFFAOYSA-N
    • SMILES: C1=NC=C(C(=O)C)C(C)=C1C(=O)C

Computed Properties

  • Exact Mass: 177.07903

Experimental Properties

  • Density: 1.093±0.06 g/cm3(Predicted)
  • Melting Point: 62-62.5 °C
  • Boiling Point: 339.0±42.0 °C(Predicted)
  • PSA: 47.03
  • pka: 2.29±0.28(Predicted)
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