trans,trans,cis-1,5,9-Cyclododecatriene

CAS Registry Number®

706-31-0
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CAS Name

trans,trans,cis-1,5,9-Cyclododecatriene

Molecular Formula

C12H18

Molecular Mass

162.27

Cite this Page

trans,trans,cis-1,5,9-Cyclododecatriene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=706-31-0 (retrieved 2024-04-20) (CAS RN: 706-31-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    96 °C @ Press: 10 Torr
  • Melting Point (2)

    -18 °C
  • Density (1)

    0.8895 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H,3-6,11-12H2/b2-1+,9-7+,10-8+

InChIKey

InChIKey=ZOLLIQAKMYWTBR-FFWAUJBHSA-N

SMILES

C/1C/C=C/CC\C=C\CC\C=C1

Canonical SMILES

C1=CCCC=CCCC=CCC1

Other Names for this Substance

  • 1,5,9-Cyclododecatriene, (1E,5E,9Z)-
  • 1,5,9-Cyclododecatriene, (E,E,Z)-
  • (1E,5E,9Z)-1,5,9-Cyclododecatriene
  • 1-cis-5-trans-9-trans-Cyclododecatriene
  • trans,trans,cis-1,5,9-Cyclododecatriene

Deleted or Replaced CAS Registry Numbers

140940-26-7, 21367-43-1, 53859-78-2

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