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7-(4-Bromobutoxy)quinolin-2(1H)-one-[d8]

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General Information
Catalog: BLP-013664
CAS: 1427053-44-8
Molecular Formula: C13H6D8BrNO2
Molecular Weight: 304.21

Chemical Structure

Description	7-(4-Bromobutoxy)quinolin-2(1H)-one-[d8] is the labelled analogue of 7-(4-Bromobutoxy)quinolin-2(1H)-one, which is a metabolite of Aripiprazole.
Synonyms	7-(4-Bromobutoxy)quinolin-2(1H)-one-d8; 7-(4-Bromobutoxy-1,1,2,2,3,3,4,4-d8)-2(1H)-quinolinone; Aripiprazole Bromo Impurity-d8; 7-(4-bromobutoxy)quinolinone-d8
IUPAC Name	7-(4-bromo-1,1,2,2,3,3,4,4-octadeuteriobutoxy)-1H-quinolin-2-one
Related CAS	203395-59-9 (unlabelled)
Canonical SMILES	C1=CC(=CC2=C1C=CC(=O)N2)OCCCCBr
InChI	InChI=1S/C13H14BrNO2/c14-7-1-2-8-17-11-5-3-10-4-6-13(16)15-12(10)9-11/h3-6,9H,1-2,7-8H2,(H,15,16)/i1D2,2D2,7D2,8D2
InChI Key	MBOHAVAGDOGRBS-RXCFTJSRSA-N
Solubility	Soluble in Chloroform, Dichloromethane
Appearance	White Solid