Cas no 76063-06-4 (11-Dodecenoic acid, ethyl ester)

11-Dodecenoic acid, ethyl ester structure
76063-06-4 structure
Product Name:11-Dodecenoic acid, ethyl ester
CAS No:76063-06-4
MF:C14H26O2
MW:226.355044841766
CID:538414
PubChem ID:17825059
Update Time:2025-04-19

11-Dodecenoic acid, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 11-Dodecenoic acid, ethyl ester
    • ethyl dodec-11-enoate
    • 76063-06-4
    • SCHEMBL817977
    • dodec-11-enoic acid ethyl ester
    • DTXSID90591139
    • ethyl 11-dodecenoate
    • Inchi: 1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h3H,1,4-13H2,2H3
    • InChI Key: ZJBHYKJKLISMQA-UHFFFAOYSA-N
    • SMILES: O(CC)C(CCCCCCCCCC=C)=O

Computed Properties

  • Exact Mass: 226.19338
  • Monoisotopic Mass: 226.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 12
  • Complexity: 176
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.1
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3

11-Dodecenoic acid, ethyl ester Pricemore >>

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