AO 412S

CAS Registry Number®

29598-76-3

CAS Name

AO 412S

Molecular Formula

C65H124O8S4

Molecular Mass

1161.94

Cite this Page

AO 412S.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29598-76-3 (retrieved 2024-11-22) (CAS RN: 29598-76-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    48-51 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C65H124O8S4/c1-5-9-13-17-21-25-29-33-37-41-49-74-53-45-61(66)70-57-65(58-71-62(67)46-54-75-50-42-38-34-30-26-22-18-14-10-6-2,59-72-63(68)47-55-76-51-43-39-35-31-27-23-19-15-11-7-3)60-73-64(69)48-56-77-52-44-40-36-32-28-24-20-16-12-8-4/h5-60H2,1-4H3

InChIKey

InChIKey=VSVVZZQIUJXYQA-UHFFFAOYSA-N

SMILES

C(COC(CCSCCCCCCCCCCCC)=O)(COC(CCSCCCCCCCCCCCC)=O)(COC(CCSCCCCCCCCCCCC)=O)COC(CCSCCCCCCCCCCCC)=O

Canonical SMILES

O=C(OCC(COC(=O)CCSCCCCCCCCCCCC)(COC(=O)CCSCCCCCCCCCCCC)COC(=O)CCSCCCCCCCCCCCC)CCSCCCCCCCCCCCC

Other Names for this Substance

  • Propanoic acid, 3-(dodecylthio)-, 1,1′-[2,2-bis[[3-(dodecylthio)-1-oxopropoxy]methyl]-1,3-propanediyl] ester
  • Propionic acid, 3-(dodecylthio)-, neopentanetetrayl ester
  • Propanoic acid, 3-(dodecylthio)-, 2,2-bis[[3-(dodecylthio)-1-oxopropoxy]methyl]-1,3-propanediyl ester
  • Pentaerythritol tetrakis(3-n-dodecylthiopropionate)
  • Pentaerythritol tetrakis[3-(dodecylthio)propionate]

View All

Deleted or Replaced CAS Registry Numbers

113285-57-7, 72847-47-3, 888324-56-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration