Trimethylolpropane trioctanoate

CAS Registry Number®

4826-87-3

CAS Name

Trimethylolpropane trioctanoate

Molecular Formula

C30H56O6

Molecular Mass

512.76

Cite this Page

Trimethylolpropane trioctanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4826-87-3 (retrieved 2024-11-22) (CAS RN: 4826-87-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Density (1)

    0.951 g/cm³ @ Temp: 15 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H56O6/c1-5-9-12-15-18-21-27(31)34-24-30(8-4,25-35-28(32)22-19-16-13-10-6-2)26-36-29(33)23-20-17-14-11-7-3/h5-26H2,1-4H3

InChIKey

InChIKey=HFWHTGSLDKKCMD-UHFFFAOYSA-N

SMILES

C(COC(CCCCCCC)=O)(COC(CCCCCCC)=O)(COC(CCCCCCC)=O)CC

Canonical SMILES

O=C(OCC(COC(=O)CCCCCCC)(COC(=O)CCCCCCC)CC)CCCCCCC

Other Names for this Substance

  • Octanoic acid, 1,1′-[2-ethyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl] ester
  • Octanoic acid, triester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol
  • Octanoic acid, 2-ethyl-2-[[(1-oxooctyl)oxy]methyl]-1,3-propanediyl ester
  • 1,3-Propanediol, 2-ethyl-2-(hydroxymethyl)-, trioctanoate
  • Trimethylolpropane tricaprylate

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Deleted or Replaced CAS Registry Numbers

79295-53-7, 850870-51-8

CAS INSIGHTSTM
Targeted protein degrader structure, illustration