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rac-Dobutamine-[d4] hydrochloride

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General Information
Catalog: BLP-014018
CAS: 1246815-74-6
Molecular Formula: C18H20D4ClNO3
Molecular Weight: 341.87

Chemical Structure

Description	rac-Dobutamine-[d4] hydrochloride is the labelled salt of Dobutamine, which is a sympathomimetic drug used to treat heart failure by inhibiting β1 receptors in the sympathetic nervous system.
Synonyms	(rac)-Dobutamine-d4 hydrochloride; 4-[2-[[3-(4-Hydroxyphenyl)-1-methylpropyl]amino]ethyl-d4]-1,2-benzenediol; DL-Dobutamine-d4 Hydrochloride; (+/-)-Dobutamine-d4 Hydrochloride; Dobutrex-d4; Inotrex-d4; NSC 299583-d4
IUPAC Name	4-[1,1,2,2-tetradeuterio-2-[4-(4-hydroxyphenyl)butan-2-ylamino]ethyl]benzene-1,2-diol;hydrochloride
Related CAS	49745-95-1 (unlabelled) 1246911-74-9 (free base) 34368-04-2 (unlabelled free base)
Canonical SMILES	CC(CCC1=CC=C(C=C1)O)NCCC2=CC(=C(C=C2)O)O.Cl
InChI	InChI=1S/C18H23NO3.ClH/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15;/h4-9,12-13,19-22H,2-3,10-11H2,1H3;1H/i10D2,11D2;
InChI Key	BQKADKWNRWCIJL-DEHBLRELSA-N
Melting Point	>77°C (dec.)
Purity	≥92%; ≥99% atom D
Solubility	Soluble in Methanol (Slightly, Sonicated), Water (Slightly)
Appearance	White to Brown Solid
Storage	Store at 2-8°C under inert atmosphere