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General Information
Catalog: BLP-011756
CAS: 1346598-95-5
Molecular Formula: C7HD6ClN4O2
Molecular Weight: 220.65
Chemical Structure
Catalog Number Size Price Stock Quantity
BLP-011756 5 mg $729 In stock
BLP-011756 10 mg $1154 In stock
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Description 8-Chlorotheophylline-[d6] is the labelled analogue of 8-Chlorotheophylline, which is a stimulant drug and a metabolite of Dyphylline. It can be used as a binding agent to form stable salts of pharmaceutical drugs.
Synonyms 8-Chlorotheophylline-d6; 8-chloro-3,9-dihydro-1,3-(dimethyl-d6)-1H-Purine-2,6-dione; 1,3-(Dimethyl-d6)-8-chloroxanthine; 8-Chloro-1,3-(dimethyl-d6)xanthine; NSC 6113-d6
IUPAC Name 8-chloro-1,3-bis(trideuteriomethyl)-7H-purine-2,6-dione
Related CAS 85-18-7 (unlabelled)
Canonical SMILES CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl
InChI InChI=1S/C7H7ClN4O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H,9,10)/i1D3,2D3
Purity ≥98%
Solubility Soluble in Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
Appearance Off-white Solid
Storage Store at 2-8°C

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