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2-Propenyl-(propyl-[d7])-propanedioic Acid Diethyl Ester

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General Information
Catalog: BLP-007789
CAS: 1215738-07-0
Molecular Formula: C13H15D7O4
Molecular Weight: 249.35

Chemical Structure

Description	A labelled compound of 2-Propenylpropylpropanedioic Acid Diethyl Ester.
Synonyms	2-(2-Propen-1-yl)-(2-propyl-d7)propanedioic Acid 1,3-Diethyl Ester
IUPAC Name	diethyl 2-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-prop-2-enylpropanedioate
Related CAS	59726-38-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C(CC=C)(C(=O)OCC)C(=O)OCC
Canonical SMILES	CCCC(CC=C)(C(=O)OCC)C(=O)OCC
InChI	InChI=1S/C13H22O4/c1-5-9-13(10-6-2,11(14)16-7-3)12(15)17-8-4/h5H,1,6-10H2,2-4H3/i2D3,6D2,10D2
InChI Key	KELSEWGOVCFKMN-GQEKAPENSA-N
Solubility	Soluble in Diethyl Ether
Appearance	Liquid