9-Octadecenoic acid (9Z)-, 1,1′-[2-ethyl-2-(hydroxymethyl)-1,3-propanediyl] ester

CAS Registry Number®

25111-05-1

CAS Name

9-Octadecenoic acid (9Z)-, 1,1′-[2-ethyl-2-(hydroxymethyl)-1,3-propanediyl] ester

Molecular Formula

C42H78O5

Molecular Mass

663.07

Cite this Page

9-Octadecenoic acid (9Z)-, 1,1′-[2-ethyl-2-(hydroxymethyl)-1,3-propanediyl] ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25111-05-1 (retrieved 2024-12-28) (CAS RN: 25111-05-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H78O5/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40(44)46-38-42(6-3,37-43)39-47-41(45)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h19-22,43H,4-18,23-39H2,1-3H3/b21-19-,22-20-

InChIKey

InChIKey=NKSZWBYBTXAALC-WRBBJXAJSA-N

SMILES

C(COC(CCCCCCC/C=C\CCCCCCCC)=O)(COC(CCCCCCC/C=C\CCCCCCCC)=O)(CC)CO

Canonical SMILES

O=C(OCC(CO)(COC(=O)CCCCCCCC=CCCCCCCCC)CC)CCCCCCCC=CCCCCCCCC

Other Names for this Substance

  • 9-Octadecenoic acid (9Z)-, 1,1′-[2-ethyl-2-(hydroxymethyl)-1,3-propanediyl] ester
  • Oleic acid, 2-ethyl-2-(hydroxymethyl)trimethylene ester
  • 9-Octadecenoic acid (Z)-, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester
  • 9-Octadecenoic acid (9Z)-, 2-ethyl-2-(hydroxymethyl)-1,3-propanediyl ester
  • 1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, dioleate

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