Cas no 53120-26-6 ((3E,13Z)-Octadecadien-1-yl Acetate)

(3E,13Z)-Octadecadien-1-yl Acetate structure
53120-26-6 structure
Product Name:(3E,13Z)-Octadecadien-1-yl Acetate
CAS No:53120-26-6
MF:C20H36O2
MW:308.498646736145
CID:937977
PubChem ID:5363259
Update Time:2025-04-19

(3E,13Z)-Octadecadien-1-yl Acetate Chemical and Physical Properties

Names and Identifiers

    • e,z-3,13-octadecadienylacetate
    • CIS,TRANS-3,13-OCTADECADIENYL ACETATE
    • (3E,13Z)-3,13-octadecadien-1-yl acetate
    • (3E,13Z)-3,13-octadecadienyl acetate
    • (3E,13Z)-octadeca-3,13-dienyl acetate
    • (E,Z)-3,13-octadecadien-1-yl acetate
    • 3(E),13(Z)-octadecadien-1-yl acetate
    • CTK0A9829
    • Cyclooctanone, 2,8-dibromo-, trans-
    • trans-2,8-Dibrom-cyclooctanon
    • trans-2,8-dibromocyclooctanone
    • trans-2,cis-13-octadecadien-1-yl acetate
    • (E,Z)-3,13-Octadecadienyl acetate
    • 3-trans-13-cis-Octadecadienyl acetate
    • Isomate LPTB
    • Isomate P
    • E3,Z13-18 Ac
    • CHEBI:180344
    • 3,13-Octadecadien-1-ol, acetate, (E,Z)-
    • UNII-9393H2PNQ9
    • AI3-36727
    • 3,13-Octadecadien-1-ol, 1-acetate, (3E,13Z)-
    • Q27271578
    • NS00032656
    • (3E,13Z)-3,13-Octadecadienyl acetate #
    • [(3E,13Z)-octadeca-3,13-dienyl] acetate
    • G72033
    • (3E,13Z)-octadecadienyl acetate
    • 3E,13Z-Octadecadienyl acetate
    • DTXSID7035301
    • 405218-61-3
    • SCHEMBL1301571
    • (13Z)-OCTADECA-3,13-DIEN-1-YL ACETATE
    • E,Z-3,13-Octadecadien-1-ol acetate
    • OCTADECADIEN-1-OL ACETATE, (E,Z)-3,13-
    • 9393H2PNQ9
    • LMFA07010386
    • (3E,13Z)-Octadecadien-1-yl acetate
    • 3,13-Octadecadien-1-ol, acetate, (3Z,13E)-
    • 3,13-Octadecadien-1-ol, acetate, (3E,13Z)-
    • EPA Pesticide Chemical Code 117202
    • EINECS 258-373-2
    • 53120-26-6
    • (3E,13Z)-octadeca-3,13-dien-1-yl acetate
    • Octadecadienyl acetate, (3E,13Z)-
    • (E,Z)-3,13-Octadecadien-1-ol acetate
    • CS-0856470
    • HY-W780787
    • (3E,13Z)-Octadecadien-1-yl Acetate
    • Inchi: 1S/C20H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h6-7,16-17H,3-5,8-15,18-19H2,1-2H3/b7-6-,17-16+
    • InChI Key: VVJPJXKHBZNADP-ZSTZHTMOSA-N
    • SMILES: O(C(C)=O)CC/C=C/CCCCCCCC/C=C\CCCC

Computed Properties

  • Exact Mass: 308.27168
  • Monoisotopic Mass: 308.271530387g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 16
  • Complexity: 292
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.5
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 0.882±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 390.3±21.0 oC (760 Torr),
  • Flash Point: 97.6±20.4 oC,
  • Refractive Index: 1.4596 (20 oC)
  • Solubility: Insuluble (9.9E-4 g/L) (25 oC),
  • PSA: 26.3

(3E,13Z)-Octadecadien-1-yl Acetate Pricemore >>

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