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Dodecanedioic acid-[d20]

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General Information
Catalog: BLP-011142
CAS: 89613-32-1
Molecular Formula: C12H2D20O4
Molecular Weight: 250.42

Chemical Structure

Description	Dodecanedioic acid-[d20] is the labelled analogue of Dodecanediic acid, which is an organic compound in the middle chain fatty acid group. It has a role as an EC 1.1.1.1 (alcohol dehydrogenase) inhibitor and a human metabolite. It is also used in cosmetics.
Synonyms	1,12-Dodecanedioic-d20 Acid; perdeuterododecanedioic acid
IUPAC Name	2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosadeuteriododecanedioic acid
Related CAS	693-23-2 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C(=O)O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O
Canonical SMILES	C(CCCCCC(=O)O)CCCCC(=O)O
InChI	InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16)/i1D2,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2
InChI Key	TVIDDXQYHWJXFK-KHKAULECSA-N
Melting Point	126-128°C (lit.)
Purity	98% atom D