D3-Caffeine

cas: 26351-03-1 — see every product listed under this CAS number, including other names

D3-Caffeine (CAS 26351-03-1) is a chemical reagent available from Chemat. Available pack sizes: 1x10mg. Offered by: HPC Standards.

brandHPC Standards
catalog number693874-1x10mg
cas26351-03-1
size1x10mg
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Available pack sizes

brand size price
HPC Standards 1x10mg price on request

properties

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

Caffeine-D3 is a deuterated compound.

Source: ChEBI

Identity
Molecular formulaC8H10N4O2
Molecular weight197.21 g/mol
IUPAC name3,7-dimethyl-1-(trideuteriomethyl)purine-2,6-dione
InChIKeyRYYVLZVUVIJVGH-HPRDVNIFSA-N
SMILES[2H]C([2H])([2H])N1C(=O)C2=C(N=CN2C)N(C1=O)C

Computed by PubChem (NCBI)

Synonyms: 3,7-dimethyl-1-(trideuteriomethyl)purine-2,6-dione, Methyltheobromine-d3, 1-(?H?)methyl-3,7-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 3,7-Dimethyl-1-(~2~H_3_)methyl-3,7-dihydro-1H-purine-2,6-dione
Related forms of this compound
1,3,7-trimethylpurine-2,6-dione C8H10N4O2
1,3,7-tri((113C)methyl)purine-2,6-dione C8H10N4O2
1,3-dimethyl-7-(trideuteriomethyl)purine-2,6-dione C8H10N4O2
1,3,7-tris(trideuteriomethyl)purine-2,6-dione C8H10N4O2
1,7-dimethyl-3-(113C)methylpurine-2,6-dione C8H10N4O2
8-deuterio-1,3,7-tris(trideuteriomethyl)purine-2,6-dione C8H10N4O2
Isomers (same molecular formula)
N-(diaminomethylideneamino)-4-hydroxybenzamide C8H10N4O2
(3S)-3-(1H-imidazol-5-ylmethyl)piperazine-2,5-dione C8H10N4O2
N-(diaminomethylideneamino)-2-hydroxybenzamide C8H10N4O2
methyl 5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate C8H10N4O2
1-N',3-N'-dihydroxybenzene-1,3-dicarboximidamide C8H10N4O2
1-N',2-N'-dihydroxybenzene-1,2-dicarboximidamide C8H10N4O2

Also listed as

Caffeine–d3 GLPBio CAS 26351-03-1
Caffeine-d3 (1-methyl-d3), >95% (HPLC) TRC CAS 26351-03-1
Caffeine-d3 (1-methyl-d3), 99 atom % D, min 98% Chemical Purity CDN CAS 26351-03-1