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Metrifonate-[13C2,d6]

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General Information
Catalog: BLP-004755
Molecular Formula: C2[13C]2H2D6Cl3O4P
Molecular Weight: 265.46

Chemical Structure

Description	Metrifonate-[13C2,d6] is the labelled analogue of Metrifonate, which is an irreversible organophosphate acetylcholinesterase inhibitor. It is used as an insecticide.
Synonyms	Metrifonate 13C2 D6; [13C2,2H6]-Trichlorfon; (2,2,2-Trichloro-1-hydroxyethyl)phosphonic Acid Dimethyl Ester-13C2,d6; (±)-Trichlorfon-13C2,d6; 1-Hydroxy-2,2,2-trichloroethylphosphonate-O,O-dimethyl Ester-13C2,d6; Agroforotox-13C2,d6
IUPAC Name	1-[bis(trideuterio(1-13C)methoxy)phosphoryl]-2,2,2-trichloroethanol
Related CAS	52-68-6 (unlabelled)
Canonical SMILES	COP(=O)(C(C(Cl)(Cl)Cl)O)OC
InChI	InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3/i1+1D3,2+1D3
InChI Key	NFACJZMKEDPNKN-KLFIIISESA-N
Purity	≥95%
Solubility	Soluble in Chloroform, Methanol
Appearance	Off-white Solid
Storage	RT