Ibuprofen aluminum

CAS Registry Number®

61054-06-6

CAS Name

Ibuprofen aluminum

Molecular Formula

C26H35AlO5

Cite this Page

Ibuprofen aluminum.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61054-06-6 (retrieved 2024-11-22) (CAS RN: 61054-06-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/2C13H18O2.Al.H2O/c2*1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;;/h2*4-7,9-10H,8H2,1-3H3,(H,14,15);;1H2/q;;+3;/p-3

InChIKey

InChIKey=QAZIXAUMDFPQRW-UHFFFAOYSA-K

SMILES

C(C(O[Al](OC(C(C)C1=CC=C(CC(C)C)C=C1)=O)O)=O)(C)C2=CC=C(CC(C)C)C=C2

Canonical SMILES

O=C(O[Al](O)OC(=O)C(C1=CC=C(C=C1)CC(C)C)C)C(C2=CC=C(C=C2)CC(C)C)C

Other Names for this Substance

  • Aluminum, hydroxybis[α-methyl-4-(2-methylpropyl)benzeneacetato-κO]-
  • Aluminum, hydroxybis[α-methyl-4-(2-methylpropyl)benzeneacetato-O]-
  • Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, aluminum complex
  • Hydroxybis[α-methyl-4-(2-methylpropyl)benzeneacetato-κO]aluminum
  • Ibuprofen aluminum

View All

CAS INSIGHTSTM
Hourglass and a clock