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Diethyl 2-n-Butylmalonate-[d9]

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General Information
Catalog: BLP-010768
CAS: 1189865-34-6
Molecular Formula: C11H11D9O4
Molecular Weight: 225.33

Chemical Structure

Description	Diethyl 2-n-Butylmalonate-[d9] is the labelled analogue of Diethyl 2-n-Butylmalonate, which is used as a reagent in the synthesis of 2,5-dihydropyrrole formyl hydroxyamino derivatives as peptide deformylase inhibitors against drug-resistant bacteria.
Synonyms	Diethyl 2-n-Butylmalonate D9; Diethyl 2-(n-butyl-d9)malonate; Butyl-malonic Acid Diethyl Ester-d9; Butyl-propanedioic Acid Diethyl Ester-d9; Butylpropanedioic Acid Diethyl Ester-d9; NSC 4565-d9
IUPAC Name	diethyl 2-(1,1,2,2,3,3,4,4,4-nonadeuteriobutyl)propanedioate
Related CAS	133-08-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(C(=O)OCC)C(=O)OCC
Canonical SMILES	CCCCC(C(=O)OCC)C(=O)OCC
InChI	InChI=1S/C11H20O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h9H,4-8H2,1-3H3/i1D3,4D2,7D2,8D2
InChI Key	RPNFNBGRHCUORR-GQWSVURBSA-N
Melting Point	130-135°C
Purity	98%; 99% atom D
Solubility	Soluble in Acetone, Chloroform, DMSO, Ethyl Acetate, Methanol
Appearance	Liquid
Storage	Store at RT