Theobromine, 99%

cas: 83-67-0 — see every product listed under this CAS number, including other names

Theobromine, 99% (CAS 83-67-0) is a chemical reagent available from Chemat. Available pack sizes: 1KG, 100g, 250g. Offered by: Thermo Scientific (Acros).

brandThermo Scientific (Acros)
catalog number258820010
cas83-67-0
size1KG
availability availability
Documents: Safety Data Sheet (MSDS)
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Available pack sizes

brand size price
Thermo Scientific (Acros) 1KG 2614.76 Pln
Thermo Scientific (Acros) 100g 449.90 Pln
Thermo Scientific (Acros) 250g 917.62 Pln

properties

delivery time2-3 weeks
categoryChemicals
purity99%
Structural formula: {0} (CAS {1})

Theobromine is a dimethylxanthine having the two methyl groups located at positions 3 and 7. A purine alkaloid derived from the cacao plant, it is found in chocolate, as well as in a number of other foods, and is a vasodilator, diuretic and heart stimulator. It has a role as a bronchodilator agent, a vasodilator agent, an adenosine receptor antagonist, a mouse metabolite, a plant metabolite, a food component and a human blood serum metabolite.

Source: ChEBI

Identity
Molecular formulaC7H8N4O2
Molecular weight180.16 g/mol
IUPAC name3,7-dimethylpurine-2,6-dione
InChIKeyYAPQBXQYLJRXSA-UHFFFAOYSA-N
SMILESCN1C=NC2=C1C(=O)NC(=O)N2C

Computed by PubChem (NCBI)

Synonyms: theobromine, 3,7-Dimethylxanthine, Diurobromine, Theosalvose, Santheose, Teobromin, Theostene, 3,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione, Thesal, 3,7-dimethylpurine-2,6-dione
Related forms of this compound
3,7-bis(trideuteriomethyl)purine-2,6-dione C7H8N4O2
Isomers (same molecular formula)
3-(3-methyl-1,2,4-oxadiazol-5-yl)-4,5-dihydro-1H-pyridazin-6-one C7H8N4O2
1,7-dimethyl-3H-purine-2,6-dione C7H8N4O2
3-(2-methyl-4-nitroimidazol-1-yl)propanenitrile C7H8N4O2
1,3-dimethyl-7H-purine-2,6-dione C7H8N4O2
1-(2-hydroxyethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one C7H8N4O2
N-cyclopropyl-5-nitropyrimidin-2-amine C7H8N4O2
3,9-dimethylpurine-2,6-dione C7H8N4O2
2-(4-nitrophenyl)guanidine C7H8N4O2
1,3-dimethyl-6H-imidazo[4,5-d]pyridazine-2,7-dione C7H8N4O2
1,9-dimethyl-3H-purine-2,6-dione C7H8N4O2
4-(hydrazinecarbonyl)pyridine-2-carboxamide C7H8N4O2

Also listed as

Theophylline-Ethylenediamine EP Impurity G (Caffeine EP Impurity D, Theobromine) Chemat Brand CAS 83-67-0
Theobromine, >95% (HPLC) TRC CAS 83-67-0
Theobromine Mikromol CAS 83-67-0
Theobromine 0.1 mg/ml in Methanol LoGiCal CAS 83-67-0
Theobromine/ 99.89% (existing batch purity) TargetMol CAS 83-67-0
Theobromine, 98.00% Chemat CAS 83-67-0
Theobromine, >98.0%(HPLC)(T) TCI CAS 83-67-0
Theobromine 98% Ambeed CAS 83-67-0
3,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione, 98%, 98% Chemat CAS 83-67-0
Theobromine, 99.78% MedChemExpress CAS 83-67-0
Theobromine (Standard) MedChemExpress CAS 83-67-0
Theobromine, ROTICHROM® HPLC, 20 mg, glass Roth CAS 83-67-0
Theobromine, ROTICHROM® CHR, 10 g, plastic Roth CAS 83-67-0
Theobromine, ROTICHROM® CHR, 100 g, plastic Roth CAS 83-67-0
Theobromine, 98% Fluorochem CAS 83-67-0