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Floctafenine-[d5]

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Floctafenine-[d5]

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General Information
Catalog: BLP-005473
CAS: 1794884-17-5
Molecular Formula: C20H12D5F3N2O4
Molecular Weight: 411.39

Chemical Structure

Description	Floctafenine-[d5] is the labelled analogue of Floctafenine. Floctafenine is a nonsteroidal anti-inflammatory drug.
Synonyms	Floctafenine D5
IUPAC Name	(1,1,2,3,3-pentadeuterio-2,3-dihydroxypropyl) 2-[[8-(trifluoromethyl)quinolin-4-yl]amino]benzoate
Related CAS	23779-99-9 (unlabelled)
Canonical SMILES	C1=CC=C(C(=C1)C(=O)OCC(CO)O)NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F
InChI	InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)/i10D2,11D2,12D
InChI Key	APQPGQGAWABJLN-XPZONWKMSA-N
Boiling Point	592.1±50.0°C at 760 mmHg
Density	1.4±0.1 g/cm3
Storage	Store at 2-8°C