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Diethyltoluamide-[d7]

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General Information
Catalog: BLP-011979
CAS: 1219799-37-7
Molecular Formula: C12H10D7NO
Molecular Weight: 198.32

Chemical Structure

Description	Diethyltoluamide-dimethyl-[d6] is a deuterium labelled diethyltoluamide is the most common active ingredient in insect repellents. Diethyltoluamide is also a contaminant of emerging concern.
Synonyms	N,N-Diethyl-3-methyl-d3-benzamide-2,4,5,6-D4
IUPAC Name	2,3,4,6-tetradeuterio-N,N-diethyl-5-(trideuteriomethyl)benzamide
Related CAS	134-62-3 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])C(=O)N(CC)CC)[2H])C([2H])([2H])[2H])[2H]
Canonical SMILES	CCN(CC)C(=O)C1=CC=CC(=C1)C
InChI	InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3/i3D3,6D,7D,8D,9D
InChI Key	MMOXZBCLCQITDF-DOVYFNGPSA-N
Boiling Point	297.5±0.0 °C at 760 mmHg
Purity	98% atom D
Density	1.0±0.1 g/cm3
Storage	Store at -20°C