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2-Acetylbutanoic-[d5] Acid Ethyl Ester

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General Information
Catalog: BLP-010346
CAS: 141327-44-8
Molecular Formula: C8H9D5O3
Molecular Weight: 163.23

Chemical Structure

Synonyms	2-Acetyl-butanoic-d5 Acid Ethyl Ester; Ethyl 2-Acetylbutanoate-d5; Ethyl 2-Ethylacetylacetate-d5; Ethyl 2-Ethyl-d5-3-ketobutyrate; Ethyl 2-Ethyl-d5-3-oxobutanoate; Ethyl 2-Ethyl-d5-3-oxobutyrate
IUPAC Name	ethyl 2-acetyl-3,3,4,4,4-pentadeuteriobutanoate
Related CAS	607-97-6 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C(C(=O)C)C(=O)OCC
Canonical SMILES	CCC(C(=O)C)C(=O)OCC
InChI	InChI=1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3/i1D3,4D2
InChI Key	OKANYBNORCUPKZ-SGEUAGPISA-N
Purity	95%
Solubility	Soluble in Dichloromethane, Ethyl Acetate and Methanol
Appearance	Colourless Liquid
Storage	Store at -20°C