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Dimethyl phthalate-[d6]

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General Information
Catalog: BLP-000498
CAS: 85448-30-2
Molecular Formula: C10H4D6O4
Molecular Weight: 200.22

Chemical Structure

Description	Dimethyl phthalate-[d6] is the labelled analogue of Dimethyl phthalate. Dimethyl phthalate is an ectoparasiticide and has many other uses, including in solid rocket propellants, plastics, and insect repellents.
Synonyms	Dimethyl-d6 phthalate; PHTHALIC ACID DIMETHYL ESTER (D6); DI(2H3)METHYL PHTHALATE; Q63409891; Dimethyl-d6 Phthalate; 1,2-Benzenedicarboxylic Acid Di(methyl-d3) Ester; Phthalsaeure-di-(trideuterio-methylester); Phthalsaeure-hexadeutero-dimethylester; dimethyl phthalate-d6; phthalic acid bis-trideuteriomethyl ester; Phthalic Acid Di(methyl-d3) Ester
IUPAC Name	bis(trideuteriomethyl) benzene-1,2-dicarboxylate
Related CAS	131-11-3 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])OC(=O)C1=CC=CC=C1C(=O)OC([2H])([2H])[2H]
Canonical SMILES	COC(=O)C1=CC=CC=C1C(=O)OC
InChI	InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3/i1D3,2D3
InChI Key	NIQCNGHVCWTJSM-WFGJKAKNSA-N
Boiling Point	282 °C
Melting Point	2 °C
Purity	≥ 98%; 98% atom D
Density	1.214 g/mL at 25 °C

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