8-Chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione (8-Chlorocaffeine)

cas: 4921-49-7 — see every product listed under this CAS number, including other names

8-Chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione (8-Chlorocaffeine) (CAS 4921-49-7) is a chemical reagent available from Chemat. Available pack sizes: 25mg. Offered by: Mikromol.

• 2D
• 3D

8-chloro-1,3,7-trimethylpurine-2,6-dione (CAS 4921-49-7) is a chemical compound with the molecular formula C8H9ClN4O2 and a molecular weight of 228.63 g/mol. IUPAC name: 8-chloro-1,3,7-trimethylpurine-2,6-dione. InChIKey: HGKPGBJNNATDRR-UHFFFAOYSA-N.

Identity

Molecular formula	C8H9ClN4O2
Molecular weight	228.63 g/mol
IUPAC name	8-chloro-1,3,7-trimethylpurine-2,6-dione
InChIKey	HGKPGBJNNATDRR-UHFFFAOYSA-N
SMILES	CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C

Computed by PubChem (NCBI)

Synonyms: 8-Chlorocaffeine, 1H-Purine-2,6-dione, 8-chloro-3,7-dihydro-1,3,7-trimethyl-, 8-Chloro Caffeine, 8-Chloro-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, 8-chloro-1,3,7-trimethylpurine-2,6-dione, Dimenhydrinate EP Impurity E, 8-chloro-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-Chloro-1,3,7-trimethyl-1H-purine-2,6(3H,7H)-dione, 8-chloro-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-Chloro-1,3,7-trimethylxanthine

Isomers (same molecular formula)

5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid;hydrochloride C₈H₉ClN₄O₂

methyl 8-amino-5-chloro-2,3-dihydroimidazo[1,2-c]pyrimidine-7-carboxylate C₈H₉ClN₄O₂

N-(2-acetamido-6-chloropyrimidin-4-yl)acetamide C₈H₉ClN₄O₂

1-(azetidin-3-yl)-2,4-dioxopyrimidine-5-carbonitrile;hydrochloride C₈H₉ClN₄O₂

4-(3-aminophenyl)-1,2,4-triazolidine-3,5-dione;hydrochloride C₈H₉ClN₄O₂

7-(2-chloroethyl)-3-methylpurine-2,6-dione C₈H₉ClN₄O₂

1-(1-methylpyrazol-3-yl)imidazole-4-carboxylic acid;hydrochloride C₈H₉ClN₄O₂

4-(4-aminophenyl)-1,2,4-triazolidine-3,5-dione;hydrochloride C₈H₉ClN₄O₂