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rac-Dobutamine-[d6] hydrochloride

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General Information
Catalog: BLP-014003
CAS: 1246818-96-1
Molecular Formula: C18H18D6ClNO3
Molecular Weight: 343.88

Chemical Structure

Description	rac-Dobutamine-[d6] hydrochloride is the labelled analogue of rac-Dobutamine, which is a sympathomimetic drug used to treat heart failure by inhibiting β1 receptors in the sympathetic nervous system.
Synonyms	(rac)-Dobutamine-d6 hydrochloride; 4-[2-[[3-(4-Hydroxyphenyl)-1-methylpropyl-d6]amino]ethyl]-1,2-benzenediol hydrochloride; DL-Dobutamine-d6 Hydrochloride; (+/-)-Dobutamine-d6 Hydrochloride; Dobutrex-d6; Inotrex-d6; NSC 299583-d6
IUPAC Name	4-[2-[[1,1,1,2,3,3-hexadeuterio-4-(4-hydroxyphenyl)butan-2-yl]amino]ethyl]benzene-1,2-diol;hydrochloride
Related CAS	49745-95-1 (unlabelled) 1246912-02-6 (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/i1D3,2D2,13D;
InChI Key	BQKADKWNRWCIJL-RUUVDYPYSA-N
Melting Point	>56°C (dec.)
Purity	≥98%
Solubility	Soluble in Methanol (Slightly), Water (slightly)
Appearance	White Solid
Storage	Store at 2-8°C under inert atmosphere