β-Calendic acid

CAS Registry Number®

822-19-5

CAS Name

β-Calendic acid

Molecular Formula

C18H30O2

Molecular Mass

278.43

Cite this Page

β-Calendic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=822-19-5 (retrieved 2024-11-22) (CAS RN: 822-19-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    77-78 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-11H,2-5,12-17H2,1H3,(H,19,20)/b7-6+,9-8+,11-10+

InChIKey

InChIKey=DQGMPXYVZZCNDQ-OBWVEWQSSA-N

SMILES

C(/C=C/C=C/C=C/CCCCC)CCCCCC(O)=O

Canonical SMILES

O=C(O)CCCCCCC=CC=CC=CCCCCC

Other Names for this Substance

  • 8,10,12-Octadecatrienoic acid, (8E,10E,12E)-
  • 8,10,12-Octadecatrienoic acid, (E,E,E)-
  • (8E,10E,12E)-8,10,12-Octadecatrienoic acid
  • trans,trans,trans-8,10,12-Octadecatrienoic acid
  • β-Calendic acid

CAS INSIGHTSTM
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