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3-Acetylthio-2-methylpropanoic Acid-[d5]

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General Information
Catalog: BLP-002681
CAS: 1189969-31-0
Molecular Formula: C6H5D5O3S
Molecular Weight: 167.24

Chemical Structure

Description	3-Acetylthio-2-methylpropanoic Acid-[d5] is the labelled analogue of 3-Acetylthio-2-methylpropionic acid (Captopril Impurity G), which is a key intermediate for Captopril and other hypertension drugs.
Synonyms	3-Acetylthio-2-methylpropanoic Acid D5; 3-Mercapto-2-methylpropionic Acid Acetate-d5; 3-Acetylsulfanyl-2-methylpropionic Acid-d5; (RS)-3-Acetylthio-2-methylpropionic Acid-d5
IUPAC Name	2-[acetylsulfanyl(dideuterio)methyl]-3,3,3-trideuteriopropanoic acid
Related CAS	33325-40-5 (unlabelled)
Canonical SMILES	CC(CSC(=O)C)C(=O)O
InChI	InChI=1S/C6H10O3S/c1-4(6(8)9)3-10-5(2)7/h4H,3H2,1-2H3,(H,8,9)/i1D3,3D2
InChI Key	VFVHNRJEYQGRGE-WNWXXORZSA-N
Solubility	Soluble in Dichloromethane, Ethyl Acetate, Methanol
Appearance	Pale Yellow Oil