Hexanedioic acid, 1,6-bis(6-methylheptyl) ester

CAS Registry Number®

105-96-4

CAS Name

Hexanedioic acid, 1,6-bis(6-methylheptyl) ester

Molecular Formula

C22H42O4

Molecular Mass

370.57

Cite this Page

Hexanedioic acid, 1,6-bis(6-methylheptyl) ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=105-96-4 (retrieved 2024-11-22) (CAS RN: 105-96-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H42O4/c1-19(2)13-7-5-11-17-25-21(23)15-9-10-16-22(24)26-18-12-6-8-14-20(3)4/h19-20H,5-18H2,1-4H3

InChIKey

InChIKey=CJFLBOQMPJCWLR-UHFFFAOYSA-N

SMILES

C(CCCCC(OCCCCCC(C)C)=O)(OCCCCCC(C)C)=O

Canonical SMILES

O=C(OCCCCCC(C)C)CCCCC(=O)OCCCCCC(C)C

Other Names for this Substance

  • Hexanedioic acid, 1,6-bis(6-methylheptyl) ester
  • Adipic acid, bis(6-methylheptyl) ester
  • Hexanedioic acid, bis(6-methylheptyl) ester
  • 1-Heptanol, 6-methyl-, adipate
  • Bis(6-methylheptyl) adipate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration