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Chlorotoluron-[d6]

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General Information
Catalog: BLP-007250
CAS: 1219803-48-1
Molecular Formula: C10H7D6ClN2O
Molecular Weight: 218.71

Chemical Structure

Description	Chlorotoluron-[d6], is the labelled analogue of Chlorotoluron. Chlortoluron is a phenylurea herbicide used to control broadleaf and annual grass weeds in cereal fields.
Synonyms	Chlorotoluron-D6; Chlorotoluron (N,N-dimethyl-d6); N'-(3-Chloro-4-methylphenyl)-N,N-(dimethyl-d6)urea
IUPAC Name	3-(3-chloro-4-methylphenyl)-1,1-bis(trideuteriomethyl)urea
Related CAS	15545-48-9 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])N(C(=O)NC1=CC(=C(C=C1)C)Cl)C([2H])([2H])[2H]
Canonical SMILES	CC1=C(C=C(C=C1)NC(=O)N(C)C)Cl
InChI	InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)/i2D3,3D3
InChI Key	JXCGFZXSOMJFOA-XERRXZQWSA-N
Melting Point	147-150°C
Purity	98% by CP; 98% atom D
Solubility	Soluble in Acetone, Acetonitrile, Chloroform, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C