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6-Mercaptopurine Monohydrate (Azathioprine EP Impurity B Monohydrate)(CAS: 6112-76-1)

6-Mercaptopurine Monohydrate (Azathioprine EP Impurity B Monohydrate)
CAS Number

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Basic Information

Molecular Formula
C5H4N4S.H2O
Molecular Weight
170.2 g/mol

Physical Properties

Melting Point
>300 °C (lit.)
Boiling Point
490.6°C at 760 mmHg
Density
2.3810
Flash Point
250.5°C

Chemical Identifiers

SMILES
C1=NC2=C(N1)C(=S)N=CN2.O
InChIKey
WFFQYWAAEWLHJC-UHFFFAOYSA-N

Database References

MDL Number
MFCD01461928
Beilstein Registry Number
4012091

FAQ

6-Mercaptopurine Monohydrate (CAS: 6112-76-1) is a chemical compound with the formula C5H4N4O2S·H2O. It is a white crystalline solid, soluble in water, and commonly used as an impurity in pharmaceuticals like Azathioprine. Its structure features a sulfur atom at the 6th position of a purine ring, making it relevant in drug synthesis and metabolic studies.
6-Mercaptopurine Monohydrate (CAS: 6112-76-1) is primarily used as an EP Impurity B in Azathioprine production. It also serves in research for analyzing drug metabolism, as a reference standard in pharmaceutical quality control, and in studies related to nucleoside analogs. Its applications are limited to non-therapeutic contexts due to its role as a byproduct in synthesis processes.
6-Mercaptopurine Monohydrate (CAS: 6112-76-1) is not intended for therapeutic use and may pose toxicity risks if mishandled. Safety precautions include wearing gloves, avoiding inhalation, and following proper waste disposal protocols. It adheres to regulatory standards for chemical handling, but its use in research should comply with safety data sheets (SDS) and OSHA guidelines to ensure minimal exposure.
6-Mercaptopurine Monohydrate (CAS: 6112-76-1) should be stored in a cool, dry place, away from light, at 2-8°C. Maintain low humidity levels and use airtight containers to preserve stability. Store in a desiccator to prevent moisture absorption and ensure compatibility with other chemicals to avoid degradation.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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