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Substance Name: Hexadecanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
RN: 3681-73-0
InChIKey: CRFQQFDSKWNZIZ-YYDJUVGSSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C26-H48-O2

Molecular Weight

  • 392.6632
 
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Names and Synonyms

Synonym

  • EC 421-370-3

Systematic Names

  • (E)-3,7-Dimethyl-2,6-octadienylhexadecanoate
  • Hexadecanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
  • Hexadecanoic acid, (2E)-3,7-dimethyl-2,6-octadienyl ester

Registry Numbers

CAS Registry Number

  • 3681-73-0

System Generated Number

  • 0003681730

Structure Descriptors

InChI

1S/C26H48O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(27)28-23-22-25(4)20-18-19-24(2)3/h19,22H,5-18,20-21,23H2,1-4H3/b25-22+

InChIKey

CRFQQFDSKWNZIZ-YYDJUVGSSA-N

Smiles

C(=O)(CCCCCCCCCCCCCCC)OC/C=C(/CC/C=C(/C)C)C