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Dexibuprofen-[d3]

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Dexibuprofen-[d3]

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General Information
Catalog: BLP-012874
CAS: 1329643-44-8
Molecular Formula: C13H15D3O2
Molecular Weight: 209.30

Chemical Structure

Description	Dexibuprofen-[d3] is the labelled analogue of Dexibuprofen, which is a nonsteroidal anti-inflammatory drug (NSAID).
Synonyms	Dexibuprofen D3; (αS)-α-(Methyl-d3)-4-(2-methylpropyl)benzeneacetic Acid; (+)-Ibuprofen-d3; (S)-2-(4-Isobutylphenyl)propanoic Acid-d3; (S)-Ibuprofen-d3; S-(+)-p-Isobutylhydratropic Acid-d3; (S)-(+)-Ibuprofen-d3
IUPAC Name	(2S)-3,3,3-trideuterio-2-[4-(2-methylpropyl)phenyl]propanoic acid
Related CAS	51146-56-6 (unlabelled)
Canonical SMILES	CC(C)CC1=CC=C(C=C1)C(C)C(=O)O
InChI	InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1/i3D3
InChI Key	HEFNNWSXXWATRW-PCXQMPHHSA-N
Melting Point	49-51°C
Purity	≥98% by HPLC; ≥99% atom D
Solubility	Soluble in Ethyl Acetate (Slightly), Methanol (Slightly)
Appearance	White Solid
Storage	Store at -20°C