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9-(4-Acetoxy-3-acetoxymethylbutyl)-2-amino-6-chloropurine-[d4]

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General Information
Catalog: BLP-009628
CAS: 1020718-81-3
Molecular Formula: C14H14D4ClN5O4
Molecular Weight: 359.8

Chemical Structure

Description	A deuterated synthetic intermediate.
Synonyms	2-[2-(2-Amino-6-chloro-9H-purin-9-yl)ethyl-1,1,2,2-d4]-1,3-propanediol 1,3-Diacetate
IUPAC Name	[2-(acetyloxymethyl)-4-(2-amino-6-chloropurin-9-yl)-3,3,4,4-tetradeuteriobutyl] acetate
Related CAS	97845-60-8 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C(COC(=O)C)COC(=O)C)C([2H])([2H])N1C=NC2=C1N=C(N=C2Cl)N
Canonical SMILES	CC(=O)OCC(CCN1C=NC2=C1N=C(N=C2Cl)N)COC(=O)C
InChI	InChI=1S/C14H18ClN5O4/c1-8(21)23-5-10(6-24-9(2)22)3-4-20-7-17-11-12(15)18-14(16)19-13(11)20/h7,10H,3-6H2,1-2H3,(H2,16,18,19)/i3D2,4D2
InChI Key	KXPSHSVVYGZKAV-KHORGVISSA-N
Melting Point	132-134°C
Purity	98%
Solubility	Chloroform (Slightly); DMSO (Slightly); Methanol (Slightly, Heated)
Appearance	White to Off-White Solid
Storage	Store at -20°C