(2E)-2-[(4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]undecanoic acid

CAS Registry Number®

136164-66-4

CAS Name

(2E)-2-[(4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]undecanoic acid

Molecular Formula

C21H30O6

Molecular Mass

378.46

Cite this Page

(2E)-2-[(4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]undecanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=136164-66-4 (retrieved 2024-11-21) (CAS RN: 136164-66-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    56-57 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H30O6/c1-5-6-7-8-9-10-11-12-15(21(24)25)13-16-14(2)17(22)19(26-3)20(27-4)18(16)23/h13H,5-12H2,1-4H3,(H,24,25)/b15-13+

InChIKey

InChIKey=AALSSIXXBDPENJ-FYWRMAATSA-N

SMILES

C(=C(\CCCCCCCCC)/C(O)=O)\C=1C(=O)C(OC)=C(OC)C(=O)C1C

Canonical SMILES

O=C(O)C(=CC=1C(=O)C(OC)=C(OC)C(=O)C1C)CCCCCCCCC

Other Names for this Substance

  • Undecanoic acid, 2-[(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]-, (2E)-
  • Undecanoic acid, 2-[(4,5-dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]-, (E)-
  • (2E)-2-[(4,5-Dimethoxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl)methylene]undecanoic acid
  • E 3330
  • APX 3330

CAS INSIGHTSTM
Targeted protein degrader structure, illustration