Di-Caffeine Mallate Powder | CAS: 69160-26-5 | 1 Gram | Professional Use Only

Di-Caffeine Malate is a caffeine–malic acid research material supplied for laboratory chemical characterization, compositional analysis, chromatographic testing, and scientific investigation.

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Di-Caffeine Malate is a caffeine–malic acid material commonly utilized in analytical laboratories for chemical characterization, compositional analysis, chromatographic method development, raw-material verification, and methylxanthine research. The material combines caffeine, a trimethylated xanthine derivative, with malic acid, a hydroxyl-containing dicarboxylic acid, producing a defined caffeine–organic acid system suitable for laboratory handling, solution preparation, and instrumental analysis. Its combination of methylxanthine and dicarboxylic-acid structural features provides characteristic physicochemical and analytical properties useful for chromatographic, spectroscopic, and comparative chemical studies. IsoPep Sciences supplies this material exclusively as a laboratory research chemical for analytical and scientific investigation.


Chemical Profile

Chemical Name: Di-Caffeine Malate

Primary Components: Caffeine 74.9%

Primary Components: Malic Acid 25%

Caffeine IUPAC Name: 1,3,7-Trimethylpurine-2,6-dione

Malic Acid IUPAC Name: 2-Hydroxybutanedioic acid

CAS Number: Not specified without supplier or batch-specific documentation

Molecular Formula: Not assigned as a single molecular formula without defined stoichiometric and solid-state characterization

Molecular Weight: Not assigned as a single molecular weight without defined stoichiometric and solid-state characterization

Chemical Class: Methylxanthine–organic acid material

Synonyms:

  • Di-Caffeine Malate
  • Dicaffeine Malate
  • Caffeine Malate
  • Caffeine–Malic Acid Complex

Appearance: White to off-white powder

Purity: Refer to batch-specific Certificate of Analysis


Structural Characteristics

Di-Caffeine Malate is a multi-component caffeine–malic acid material rather than a conventional single-component molecular substance that should automatically be represented by one discrete molecular formula.

Caffeine possesses a fused nitrogen-containing methylxanthine framework incorporating two carbonyl groups and three N-methyl substituents. This conjugated heterocyclic structure provides characteristic ultraviolet, infrared, nuclear magnetic resonance, and mass-spectrometric signatures useful during analytical identification.

Malic acid is a four-carbon dicarboxylic acid containing two carboxylic acid functionalities and one secondary hydroxyl group. These oxygen-containing functional groups contribute distinct hydrogen-bonding, acid-base, chromatographic, and spectroscopic characteristics.

Association of caffeine with malic acid can influence physicochemical characteristics such as crystallinity, aqueous behavior, thermal properties, hydrogen-bonding interactions, and chromatographic behavior relative to the individual starting materials.

Because commercial Di-Caffeine Malate materials may be defined according to a particular manufacturing specification or compositional ratio, molecular formula, molecular weight, and structural representation should be based on supplier documentation and batch-specific analytical characterization rather than inferred solely from the product name.


Analytical Considerations

Typical laboratory characterization may include:

  • High-Performance Liquid Chromatography (HPLC)
  • Ultra-Performance Liquid Chromatography (UPLC)
  • Liquid Chromatography–Mass Spectrometry (LC-MS)
  • Proton Nuclear Magnetic Resonance (^1H NMR)
  • Carbon-13 Nuclear Magnetic Resonance (^13C NMR)
  • Fourier Transform Infrared Spectroscopy (FTIR)
  • Ultraviolet-Visible Spectroscopy (UV-Vis)
  • High-Resolution Mass Spectrometry (HRMS)
  • Water-content determination
  • Sulphated ash analysis
  • Thermal or melting-range analysis
  • Quantitative caffeine analysis
  • Quantitative malic acid analysis

Because Di-Caffeine Malate contains chemically distinct caffeine and malic acid components, analytical methods capable of independently identifying and quantifying each constituent may be particularly useful during identity and compositional assessment.

Chromatographic analysis can be used to evaluate caffeine content, while complementary methods may be employed for malic acid identification and quantification. Spectroscopic and thermal techniques can provide additional information regarding material identity, intermolecular association, and solid-state characteristics.

Batch-specific Certificates of Analysis should be referenced when available.


Handling & Storage

  • Store in a tightly sealed container.
  • Protect from excessive heat, moisture, and direct sunlight.
  • Store in a cool, dry environment.
  • Minimize unnecessary exposure to ambient moisture during laboratory handling.
  • Handle using appropriate laboratory PPE.
  • Avoid inhalation of dust and direct skin or eye contact.
  • Prevent cross-contamination with other laboratory reference materials or chemical standards.
  • Use only in properly equipped laboratory environments.
  • Consult the applicable Safety Data Sheet (SDS) before handling.

Research Use Disclaimer

This product is supplied exclusively for legitimate laboratory research, analytical testing, and scientific investigation. It is not intended for human consumption, veterinary use, therapeutic applications, food use, cosmetic use, or household use. Researchers are responsible for handling this material in accordance with applicable laboratory safety procedures and regulations.