Pentaerythritol tetrabehenate

CAS Registry Number®

61682-73-3

CAS Name

Pentaerythritol tetrabehenate

Molecular Formula

C93H180O8

Molecular Mass

1426.42

Cite this Page

Pentaerythritol tetrabehenate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61682-73-3 (retrieved 2024-11-21) (CAS RN: 61682-73-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C93H180O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-69-73-77-81-89(94)98-85-93(86-99-90(95)82-78-74-70-66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,87-100-91(96)83-79-75-71-67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)88-101-92(97)84-80-76-72-68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h5-88H2,1-4H3

InChIKey

InChIKey=SMLXTTLNOGQHHB-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Docosanoic acid, 1,1′-[2,2-bis[[(1-oxodocosyl)oxy]methyl]-1,3-propanediyl] ester
  • Docosanoic acid, 2,2-bis[[(1-oxodocosyl)oxy]methyl]-1,3-propanediyl ester
  • Pentaerythritol, tetradocosanoate
  • Pentaerythritol tetrabehenate
  • WEP 5F

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Deleted or Replaced CAS Registry Numbers

331229-61-9, 722538-91-2, 1674364-68-1

CAS INSIGHTSTM
Targeted protein degrader structure, illustration