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Climbazole-[d4]

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General Information
Catalog: BLP-008228
CAS: 1185117-79-6
Molecular Formula: C15H13D4ClN2O2
Molecular Weight: 296.79

Chemical Structure

Description	Climbazole-[d4] is the labelled analogue of Climbazole. Climbazole is a topical antifungal agent commonly used in the treatment of human fungal skin infections such as dandruff and eczema.
Synonyms	Climbazole-d4; 1-(4-Chlorophenoxy)-1-(1H-imidazol-1-yl)-3,3-dimethyl-2-butanone-d4; 1-[(4-Chlorophenoxy)(tert-butylcarbonyl)methyl]imidazole-d4; Baypival-d4; Crinipan AD-d4
IUPAC Name	1-(4-chloro-2,3,5,6-tetradeuteriophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one
Related CAS	38083-17-9 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1OC(C(=O)C(C)(C)C)N2C=CN=C2)[2H])[2H])Cl)[2H]
Canonical SMILES	CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl
InChI	InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3/i4D,5D,6D,7D
InChI Key	OWEGWHBOCFMBLP-UGWFXTGHSA-N
Melting Point	82-84°C
Purity	≥97%; ≥97% atom D
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C