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Substance Name: Carboxyibuprofen
RN: 15935-54-3
UNII: 2RI5XR466K
InChIKey: DIVLBIVDYADZPL-UHFFFAOYSA-N

Note

  • Major urinary metabolite of ibuprofen.

Molecular Weight

  • 236.2654
 
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Names and Synonyms

Name of Substance

  • Carboxyibuprofen

Synonyms

  • 2,4'-(2-Carboxypropyl)phenylpropionic acid
  • 2-(4-(2-Carboxypropyl)phenyl)propionic acid
  • Benzeneacetic acid, 4-(2-carboxypropyl)-alpha-methyl-
  • Benzenepropanoic acid, 4-(1-carboxyethyl)-alpha-methyl-
  • Carboxyibuprofen
  • Ibuprofen COOH
  • UNII-2RI5XR466K

Registry Numbers

CAS Registry Number

  • 15935-54-3

FDA UNII

  • 2RI5XR466K

System Generated Number

  • 0015935543

Structure Descriptors

InChI

1S/C13H16O4/c1-8(12(14)15)7-10-3-5-11(6-4-10)9(2)13(16)17/h3-6,8-9H,7H2,1-2H3,(H,14,15)(H,16,17)

InChIKey

DIVLBIVDYADZPL-UHFFFAOYSA-N

Smiles

CC(Cc1ccc(cc1)C(C)C(=O)O)C(=O)O