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Deuterium
7-(4-Iodobutoxy)-3,4-dihydroquinolin-2-one-[d8]

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7-(4-Iodobutoxy)-3,4-dihydroquinolin-2-one-[d8]

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General Information
Catalog: BLP-013803
CAS: 1346599-53-8
Molecular Formula: C13H8D8INO2
Molecular Weight: 353.23

Chemical Structure

Description	7-(4-Iodobutoxy)-3,4-dihydroquinolin-2-one-[d8] is the labelled analogue of 7-(4-Iodobutoxy)-3,4-dihydroquinolin-2-one, which is an impurity in the synthesis of Aripiprazole.
Synonyms	7-(4-Iodobutoxy)-3,4-dihydroquinolin-2-one-d8; 3,4-Dihydro-7-(4-iodobutoxy-d8)-2(1H)-quinolinone
IUPAC Name	7-(1,1,2,2,3,3,4,4-octadeuterio-4-iodobutoxy)-3,4-dihydro-1H-quinolin-2-one
Related CAS	952308-47-3 (unlabelled)
Canonical SMILES	C1CC(=O)NC2=C1C=CC(=C2)OCCCCI
InChI	InChI=1S/C13H16INO2/c14-7-1-2-8-17-11-5-3-10-4-6-13(16)15-12(10)9-11/h3,5,9H,1-2,4,6-8H2,(H,15,16)/i1D2,2D2,7D2,8D2
InChI Key	FFXAPBRVNCEGQG-RXCFTJSRSA-N
Solubility	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance	Off-white Solid
Storage	Store at 2-8°C