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(+/-)-Imazalil-[d5] Sulfate

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General Information
Catalog: BLP-001627
CAS: 1398065-92-3
Molecular Formula: C14H11D5Cl2N2O5S
Molecular Weight: 400.28

Chemical Structure

Description	(+/-)-Imazalil-[d5] Sulfate, is the labelled analogue of Imazalil. Imazalil, is a fungicide widely used in agriculture, particularly in the growing of citrus fruits.
Synonyms	Imazalil-d5 Sulfate; 1-[2-(2,4-Dichlorophenyl)-2-[2-(propen-1-yl-d5)oxy]ethyl]-1H-imidazole Sulfate; 1-[2-(2,4-Dichlorophenyl)-2-[2-(propenyl-d5)oxy]ethyl]-1H-imidazole Sulfate; Chloramizol-d5 Sulfate; Microban Additive IF 4-d5; R 27180-d5
IUPAC Name	1-[2-(2,4-dichlorophenyl)-2-(1,1,2,3,3-pentadeuterioprop-2-enoxy)ethyl]imidazole;sulfuric acid
Related CAS	58594-72-2 (unlabelled)
Canonical SMILES	C=CCOC(CN1C=CN=C1)C2=C(C=C(C=C2)Cl)Cl.OS(=O)(=O)O
InChI	InChI=1S/C14H14Cl2N2O.H2O4S/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16;1-5(2,3)4/h2-6,8,10,14H,1,7,9H2;(H2,1,2,3,4)/i1D2,2D,7D2;
InChI Key	XVTXMTOYQVRHSK-XXANSLCBSA-N
Melting Point	129-131°C
Purity	95% by HPLC; 98% atom D
Solubility	Soluble in Chloroform, Methanol, Water
Appearance	White to Off-white Solid
Storage	Store at -20°C, under inert atmosphere