1,1′-(1-Methyl-1,3-propanediyl) dioctanoate

CAS Registry Number®

4554-00-1

CAS Name

1,1′-(1-Methyl-1,3-propanediyl) dioctanoate

Molecular Formula

C20H38O4

Molecular Mass

342.51

Cite this Page

1,1′-(1-Methyl-1,3-propanediyl) dioctanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4554-00-1 (retrieved 2024-12-23) (CAS RN: 4554-00-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    171-175 °C @ Press: 0.3 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H38O4/c1-4-6-8-10-12-14-19(21)23-17-16-18(3)24-20(22)15-13-11-9-7-5-2/h18H,4-17H2,1-3H3

InChIKey

InChIKey=LFESLSYSZQYEIZ-UHFFFAOYSA-N

SMILES

C(OC(CCCCCCC)=O)(CCOC(CCCCCCC)=O)C

Canonical SMILES

O=C(OCCC(OC(=O)CCCCCCC)C)CCCCCCC

Other Names for this Substance

  • Octanoic acid, 1,1′-(1-methyl-1,3-propanediyl) ester
  • Octanoic acid, 1-methyltrimethylene ester
  • Octanoic acid, 1-methyl-1,3-propanediyl ester
  • 1,1′-(1-Methyl-1,3-propanediyl) dioctanoate
  • 1,3-Butanediol dioctylate

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