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Diflunisal-[d3]

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Diflunisal-[d3]

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General Information
Catalog: BLP-012316
CAS: 1286107-99-0
Molecular Formula: C13H5D3F2O3
Molecular Weight: 253.22

Chemical Structure

Description	Diflunisal-[d3] is a labelled Diflunisal. Diflunisal is a nonsteroidal anti-inflammatory drug (NSAID) used for inflammations.
Synonyms	Diflunisal D3
IUPAC Name	2,4,5-trideuterio-3-(2,4-difluorophenyl)-6-hydroxybenzoic acid
Related CAS	22494-42-4 (unlabelled)
Canonical SMILES	C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O
InChI	InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)/i1D,4D,5D
InChI Key	HUPFGZXOMWLGNK-NHPOFCFZSA-N
Boiling Point	386.9±42.0 °C at 760 mmHg
Purity	95% by HPLC; 95% atom D
Density	1.4±0.1 g/cm3
Storage	Store at -20°C