1,1′-(2-Hydroxy-1,3-propanediyl) didocosanoate

CAS Registry Number®

94201-62-4
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CAS Name

1,1′-(2-Hydroxy-1,3-propanediyl) didocosanoate

Molecular Formula

C47H92O5

Molecular Mass

737.23

Cite this Page

1,1′-(2-Hydroxy-1,3-propanediyl) didocosanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=94201-62-4 (retrieved 2024-05-07) (CAS RN: 94201-62-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    42 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C47H92O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(49)51-43-45(48)44-52-47(50)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h45,48H,3-44H2,1-2H3

InChIKey

InChIKey=GYNODFLZPXTEPN-UHFFFAOYSA-N

SMILES

C(C(COC(CCCCCCCCCCCCCCCCCCCCC)=O)O)OC(CCCCCCCCCCCCCCCCCCCCC)=O

Canonical SMILES

O=C(OCC(O)COC(=O)CCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC

Other Names for this Substance

  • Docosanoic acid, 1,1′-(2-hydroxy-1,3-propanediyl) ester
  • Docosanoic acid, 2-hydroxy-1,3-propanediyl ester
  • 1,1′-(2-Hydroxy-1,3-propanediyl) didocosanoate
  • 1,3-Dibehenin
  • 2-Hydroxypropane-1,3-diyl didocosanoate

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