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1-Hydroxy Ibuprofen (Ibuprofen Impurity L)(Mixture of Diastereomers) - CAS 53949-53-4

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Catalog Number: R010460

CAS Number: 53949-53-4

PubChem Substance ID:355072945

Molecular Formula: C13H18O3

Molecular Weight:222.284

Purity: ≥95%

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Synonym

Synonyms4-(1-Hydroxy-2-methylpropyl)-α-methylbenzeneacetic Acid;?2-[4’-(1-Hydroxy-2-methylpropyl)phenyl]propionic Acid; Ibuprofen Impurity L;

Property

Molecular Formula: C13H18O3
Molecular Weight222.284
Purity≥95%
Storage-20°C

Computed Descriptor

IUPAC Name2-[4-(1-hydroxy-2-methylpropyl)phenyl]propanoic acid
InChIInChI=1S/C13H18O3/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9,12,14H,1-3H3,(H,15,16)
InChIKeyRMOQYHYFRKTDRI-UHFFFAOYSA-N
SMILESCC(C)C(C1=CC=C(C=C1)C(C)C(=O)O)O