Cas no 127633-91-4 (1,3-Dioxane-4,6-dione, 5-(5-hydroxy-2-pyrrolidinylidene)-2,2-dimethyl-)

1,3-Dioxane-4,6-dione, 5-(5-hydroxy-2-pyrrolidinylidene)-2,2-dimethyl- structure
127633-91-4 structure
Product Name:1,3-Dioxane-4,6-dione, 5-(5-hydroxy-2-pyrrolidinylidene)-2,2-dimethyl-
CAS No:127633-91-4
MF:C10H13NO5
MW:227.213923215866
CID:1221754
Update Time:2024-08-03

1,3-Dioxane-4,6-dione, 5-(5-hydroxy-2-pyrrolidinylidene)-2,2-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Dioxane-4,6-dione, 5-(5-hydroxy-2-pyrrolidinylidene)-2,2-dimethyl-
    • Inchi: 1S/C10H13NO5/c1-10(2)15-8(13)7(9(14)16-10)5-3-4-6(12)11-5/h6,11-12H,3-4H2,1-2H3
    • InChI Key: QTBZQVHMIUVNLD-UHFFFAOYSA-N
    • SMILES: O1C(=O)/C(=C2/CCC(O)N/2)/C(=O)OC1(C)C

Computed Properties

  • Exact Mass: 227.07939

Experimental Properties

  • Density: 1.380±0.06 g/cm3(Predicted)
  • Boiling Point: 489.1±45.0 °C(Predicted)
  • PSA: 84.86
  • pka: 13.61±0.20(Predicted)

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