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Tenofovir diethyl ester-[d6]

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General Information
Catalog: BLP-010656
CAS: 1020719-38-3
Molecular Formula: C13H16D6N5O4P
Molecular Weight: 349.36

Chemical Structure

Description	Tenofovir diethyl ester-[d6] is the labelled analogue of Tenofovir diethyl ester, which is an impurity of Tenofovir.
Synonyms	9-[2-(Diethylphosphonomethoxy)propyl-d6] Adenine; P-[[(2-(6-Amino-9H-purin-9-yl)-1-methylethoxy]methyl]phosphonic Acid Diethyl Ester-D6; 9-[2-(Diethylphosphonomethoxy)propyl] Adenine-d6; Phosphonic Acid, P-[[1-[(6-Amino-9H-purin-9-yl)methyl-d2]ethoxy-1,2,2,2-d4]methyl]-, diethyl ester
IUPAC Name	9-[1,1,2,3,3,3-hexadeuterio-2-(diethoxyphosphorylmethoxy)propyl]purin-6-amine
Related CAS	180587-75-1 (unlabelled)
Canonical SMILES	CCOP(=O)(COC(C)CN1C=NC2=C(N=CN=C21)N)OCC
InChI	InChI=1S/C13H22N5O4P/c1-4-21-23(19,22-5-2)9-20-10(3)6-18-8-17-11-12(14)15-7-16-13(11)18/h7-8,10H,4-6,9H2,1-3H3,(H2,14,15,16)/i3D3,6D2,10D
InChI Key	GCOFRXOOFANVPB-QIMZAQQXSA-N
Melting Point	150-152°C
Purity	≥98%
Solubility	Soluble in Dichloromethane, Ethyl Acetate, Methanol
Appearance	White Solid
Application	A deuterated acyclic phosphonate nucleotide.
Storage	Store at -20°C