| Identification | Back Directory | [Name]
CAFFEINE (TRIMETHYL-13C3) | [CAS]
78072-66-9 | [Synonyms]
CAFFEINE-13C3
Caffeine-13C3 solution
CAFFEINE (TRIMETHYL-13C3)
Caffeine-trimethyl-13C3 solution
CAFFEINE-TRIMETHYL-13C3, 99 ATOM % 13C
CAFFEINE (13C3, 99%) 1.0 MG/ML IN METHANOL
CAFFEINE (TRIMETHYL-13C3, 99%) 100 UG/ML IN METHANOL | [Molecular Formula]
C8H12N4O2 | [MDL Number]
MFCD00143899 | [MOL File]
78072-66-9.mol | [Molecular Weight]
199.23 |
| Chemical Properties | Back Directory | [Melting point ]
234-236.5 °C(lit.) | [Fp ]
11 °C | [storage temp. ]
2-8°C | [solubility ]
DMSO (Slightly, Heated, Sonicated), Methanol (Slightly, Heated, Sonicated) | [form ]
Solid | [color ]
White to Off-White | [InChI]
1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3/i1+1,2+1,3+1 | [InChIKey]
RYYVLZVUVIJVGH-VMIGTVKRSA-N | [SMILES]
[13CH3]N1C(=O)N([13CH3])c2ncn([13CH3])c2C1=O | [EPA Substance Registry System]
1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-tri(methyl-13C)- (78072-66-9) | [CAS Number Unlabeled]
58-08-2 |
| Hazard Information | Back Directory | [Uses]
Caffeine-13C3 is a labelled analogue of Caffeine (C080100), a bitter, white crystalline xanthine alkaloid that acts as a stimulant drug and a reversible acetylcholinesterase inhibitor. Caffeine is found in varying quantities in the seeds, leaves, and fruit of some plants, where it acts as a natural pesticide that paralyzes and kills certain insects feeding on the plants. In humans, caffeine acts as a central nervous system stimulant, temporarily warding off drowsiness and restoring alertness. Caffeine is a cardiac and respiratory stimulant; diuretic. Caffeine is toxic at sufficiently high doses.A study at Johns Hopkins University indicates that caffeine can improve pattern separation memory. | [Definition]
ChEBI: Caffeine-trimethyl-13C3 is an oxopurine. |
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