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Aripiprazole-[butyl-d8]

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General Information
Catalog: BLP-008111
CAS: 1089115-04-7
Molecular Formula: C23H19D8Cl2N3O2
Molecular Weight: 456.43

Chemical Structure

Description	Aripiprazole-[d8] is a labelled analogue of Aripiprazole. Aripiprazole is an atypical antipsychotic.
Synonyms	Aripiprazole-(butoxy-D8); Aripiprazole-d8; 2(1H)-Quinolinone, 7-[4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy-1,1,2,2,3,3,4,4-d8]-3,4-dihydro-; 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy-1,1,2,2,3,3,4,4-d8]-3,4-dihydro-2(1H)-quinolinone; Aripiprazole-d8 (Butyl-d8)
IUPAC Name	7-[1,1,2,2,3,3,4,4-octadeuterio-4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
Related CAS	129722-12-9 (unlabelled)
Canonical SMILES	C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl
InChI	InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)/i1D2,2D2,10D2,15D2
InChI Key	CEUORZQYGODEFX-BQLKVSHCSA-N
Melting Point	131-133°C
Purity	98% by CP; 98% atom D
Solubility	Soluble in Chloroform (Slightly), DMSO (Slightly)
Appearance	White to Off-white Solid
Storage	Store at -20°C