Cas no 13296-76-9 (9,11,13-Octadecatrienoicacid)

9,11,13-Octadecatrienoicacid structure
9,11,13-Octadecatrienoicacid structure
Product Name:9,11,13-Octadecatrienoicacid
CAS No:13296-76-9
MF:C18H30O2
MW:278.429605960846
CID:157746
PubChem ID:93077
Update Time:2025-04-19

9,11,13-Octadecatrienoicacid Chemical and Physical Properties

Names and Identifiers

    • 9,11,13-Octadecatrienoicacid
    • octadeca-9-cis, 11-trans, 13-trans-trienoic acid
    • (9E,11E,13E)-octadeca-9,11,13-trienoic acid
    • (9E,11E,13Z)-octadeca-9,11,13-trienoic acid
    • Elaeostearic acid, crude
    • ELAEOSTERARIC ACID
    • Eleostearic acid
    • NSC 407903
    • octadeca-9,11,13-trienoic acid
    • Elaeostearinsure, roh
    • 9,11,13-Octadecatrienoic acid
    • NS00018678
    • CUXYLFPMQMFGPL-UHFFFAOYSA-N
    • NS00084798
    • DTXSID00870604
    • Q27117708
    • PD049203
    • 13296-76-9
    • 9,11,13-CLN
    • Inchi: 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-10H,2-4,11-17H2,1H3,(H,19,20)
    • InChI Key: CUXYLFPMQMFGPL-UHFFFAOYSA-N
    • SMILES: OC(CCCCCCCC=CC=CC=CCCCC)=O

Computed Properties

  • Exact Mass: 278.2247
  • Monoisotopic Mass: 278.225
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 13
  • Complexity: 301
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 3
  • XLogP3: 6.4
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 0.924
  • Boiling Point: 390.6°Cat760mmHg
  • Flash Point: 287.4°C
  • Refractive Index: 1.49
  • PSA: 37.3

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