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Propiconazole-[d7]

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General Information
Catalog: BLP-012539
CAS: 1246818-14-3
Molecular Formula: C15H10D7Cl2N3O2
Molecular Weight: 349.26

Chemical Structure

Description	Propiconazole-[d7] is the labelled analogue of Propiconazole. Propiconazole is a triazole fungicide inhibiting fungicide due to its binding with and inhibiting the 14-alpha demethylase enzyme from demethylating a precursor to ergosterol.
Synonyms	Propiconazole D7; 1-[[2-(2,4-Dichlorophenyl)-4-(propyl-d7)-1,3-dioxolan-2-yl]methyl]-1H-1,2,4-triazole; Bamper-d7
IUPAC Name	1-[[2-(2,4-dichlorophenyl)-4-(1,1,2,2,3,3,3-heptadeuteriopropyl)-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
Related CAS	60207-90-1 (unlabelled)
Canonical SMILES	CCCC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl
InChI	InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3/i1D3,2D2,3D2
InChI Key	STJLVHWMYQXCPB-NCKGIQLSSA-N
Boiling Point	480.0±55.0 °C at 760 mmHg
Purity	95% by HPLC; 95% atom D
Density	1.4±0.1 g/cm3
Appearance	Pale Yellow to Light Brown Oil to Semi Solid
Storage	Store at -20°C