Cas no 144192-27-8 (Cyclohexanecarboxylic acid, 2-ethyl-6-oxo-, ethyl ester)

Cyclohexanecarboxylic acid, 2-ethyl-6-oxo-, ethyl ester structure
144192-27-8 structure
Product Name:Cyclohexanecarboxylic acid, 2-ethyl-6-oxo-, ethyl ester
CAS No:144192-27-8
MF:C11H18O3
MW:198.258823871613
CID:1314868
Update Time:2024-08-18

Cyclohexanecarboxylic acid, 2-ethyl-6-oxo-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanecarboxylic acid, 2-ethyl-6-oxo-, ethyl ester
    • Inchi： 1S/C11H18O3/c1-3-8-6-5-7-9(12)10(8)11(13)14-4-2/h8,10H,3-7H2,1-2H3
    • InChI Key： WQSQXBIEUVEYBU-UHFFFAOYSA-N
    • SMILES： C1(C(OCC)=O)C(=O)CCCC1CC

Computed Properties

  • Exact Mass: 198.12564

Experimental Properties

  • Density: 1.018±0.06 g/cm3(Predicted)
  • Boiling Point: 276.5±33.0 °C(Predicted)
  • PSA: 43.37
  • pka: 12.12±0.40(Predicted)

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