Cas no 192524-32-6 (Ethyl 3-oxocyclononane-1-carboxylate)

Ethyl 3-oxocyclononane-1-carboxylate structure
192524-32-6 structure
Product Name:Ethyl 3-oxocyclononane-1-carboxylate
CAS No:192524-32-6
MF:C12H20O3
MW:212.285404205322
CID:2787650
Update Time:2023-08-07

Ethyl 3-oxocyclononane-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 3-oxocyclononane-1-carboxylate
    • 3-Oxocyclononanecarboxylic acid ethyl ester
    • Inchi: 1S/C12H20O3/c1-2-15-12(14)10-7-5-3-4-6-8-11(13)9-10/h10H,2-9H2,1H3
    • InChI Key: AASVSTZJTSOBRU-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1CC(CCCCCC1)=O)=O

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 223
  • XLogP3: 2.2
  • Topological Polar Surface Area: 43.4
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