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2,4-Difluoro-α-(1H-1,2,4-triazolyl)acetophenone-[d2]

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2,4-Difluoro-α-(1H-1,2,4-triazolyl)acetophenone-[d2]

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General Information
Catalog: BLP-007694
CAS: 1124197-63-2
Molecular Formula: C10H5D2F2N3O
Molecular Weight: 225.19

Chemical Structure

Description	2,4-Difluoro-α-(1H-1,2,4-triazolyl)acetophenone-[d2] is a labelled intermediate of Fluconazole. Fluconazole is a triazole antifungal agent that is effective against most Candida strains.
Synonyms	1-(2,4-Difluorophenyl)-2-(1H-1,2,4-triazol-1-yl)-ethanone-d2; 2',4'-Difluoro-2-(1H-1,2,4-triazol-1-yl)acetophenone-d2
IUPAC Name	2,2-dideuterio-1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone
Related CAS	86404-63-9 (unlabelled)
Canonical SMILES	C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2
InChI	InChI=1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2/i4D2
InChI Key	XCHRPVARHBCFMJ-APZFVMQVSA-N
Solubility	Soluble in Chloroform, Dichloromethane, Methanol
Appearance	Light Yellow Solid
Storage	Store at -20°C