Products 2530-99-6

CAS 2530-99-6 is the registry number for Theophylline Impurity 18. Offered by: Chemat Brand. Available pack sizes: on request.

Theophylline Impurity 18
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

3,7-dimethyl-1-prop-2-enylpurine-2,6-dione (CAS 2530-99-6) is a chemical compound with the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. IUPAC name: 3,7-dimethyl-1-prop-2-enylpurine-2,6-dione. InChIKey: BTFHIKZOEZREBX-UHFFFAOYSA-N.

Identity
Molecular formulaC10H12N4O2
Molecular weight220.23 g/mol
IUPAC name3,7-dimethyl-1-prop-2-enylpurine-2,6-dione
InChIKeyBTFHIKZOEZREBX-UHFFFAOYSA-N
SMILESCN1C=NC2=C1C(=O)N(C(=O)N2C)CC=C

Computed by PubChem (NCBI)

Synonyms: 1-Allyltheobromine, Theobromine, 1-allyl-, 3,7-Dihydro-3,7-dimethyl-1-(2-propen-1-yl)-1H-purine-2,6-dione, Allyltheobromine, 3,7-dimethyl-1-prop-2-enylpurine-2,6-dione, 3,7-dimethyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione, Allyltheobromin, 1-Allyl-3,7-dimethyl-3,7-dihydro-purine-2,6-dione, Theophylline Impurity 18, 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-1-(2-propenyl)-
Isomers (same molecular formula)
1,3-dimethyl-5-(4-methylpyrazol-1-yl)pyrazole-4-carboxylic acid C10H12N4O2
7-tert-butyl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid C10H12N4O2
ethyl 7-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate C10H12N4O2
1-(methoxymethyl)indazole-5-carbohydrazide C10H12N4O2
4-[4-(dimethylamino)phenyl]-1,2,4-triazolidine-3,5-dione C10H12N4O2
N-methoxy-N,3-dimethylimidazo[4,5-b]pyridine-6-carboxamide C10H12N4O2
6-amino-3-(2-methoxyethyl)-1,2,3-benzotriazin-4-one C10H12N4O2
benzyl N-(2-azidoethyl)carbamate C10H12N4O2
4-amino-N-(furan-2-ylmethyl)-1-methylpyrazole-5-carboxamide C10H12N4O2
1-[2-(methoxymethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone C10H12N4O2
4-(3-aminophenyl)-1,2-dimethyl-1,2,4-triazolidine-3,5-dione C10H12N4O2
4-(4-aminophenyl)-1,2-dimethyl-1,2,4-triazolidine-3,5-dione C10H12N4O2