rel-(2R,3S)-3-Octyl-2-oxiranedodecanoic acid

CAS Registry Number®

3420-36-8
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CAS Name

rel-(2R,3S)-3-Octyl-2-oxiranedodecanoic acid

Molecular Formula

C22H42O3

Molecular Mass

354.57

Cite this Page

rel-(2R,3S)-3-Octyl-2-oxiranedodecanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3420-36-8 (retrieved 2024-09-07) (CAS RN: 3420-36-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    63.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1/C22H42O3/c1-2-3-4-5-11-14-17-20-21(25-20)18-15-12-9-7-6-8-10-13-16-19-22(23)24/h20-21H,2-19H2,1H3,(H,23,24)/t20-,21+/s2

InChIKey

InChIKey=NSYDMBURIUSUDH-VJOGAFQXNA-N

SMILES

C(CCCCCCCCCCC(O)=O)[C@H]1[C@@H](CCCCCCCC)O1

Canonical SMILES

O=C(O)CCCCCCCCCCCC1OC1CCCCCCCC

Other Names for this Substance

  • 2-Oxiranedodecanoic acid, 3-octyl-, (2R,3S)-rel-
  • Docosanoic acid, 13,14-epoxy-, cis-
  • Oxiranedodecanoic acid, 3-octyl-, cis-
  • Oxiranedodecanoic acid, 3-octyl-, (2R,3S)-rel-
  • rel-(2R,3S)-3-Octyl-2-oxiranedodecanoic acid