Sinigrin(CAS: 3952-98-5)

CAS Number
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Basic Information
Molecular Formula
C10H16KNO9S2
Molecular Weight
398.48 g/mol
Physical Properties
Melting Point
128 (dec.) (lit.)
Water Solubility
almost transparency
Chemical Identifiers
SMILES
C=CCC(=NOS(=O)(=O)[O-])SC1C(C(C(C(O1)CO)O)O)O.[K+]
InChIKey
BSNLGANCHAHVBW-JMJVLJGISA-L
Database References
MDL Number
MFCD00149447
FAQ
Sinigrin is a crystalline compound with a molecular weight of approximately 322.21 g/mol. It is slightly soluble in water and ethanol. Sinigrin is moderately reactive, particularly under acidic conditions, and can undergo hydrolysis to release isothiocyanates. Its melting point is around 220°C. It is used in various applications due to its unique chemical properties.
Sinigrin can be synthesized through the condensation of sinapaldehyde and isothiocyanate in the presence of a base such as sodium hydroxide. The synthesis yields sinigrin with a high degree of purity. The process is selective and achieves a yield of about 75-85%. This method is widely used in the production of sinigrin for various applications.
Sinigrin (CAS: 3952-98-5) is used in the pharmaceutical industry for its anti-inflammatory and antimicrobial properties. It is also used in the food industry as a flavor enhancer and preservative. Additionally, it finds applications in the agricultural sector as a pest repellent and in the development of biosensors due to its chemical reactivity.
When handling sinigrin, it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety glasses, and a lab coat. It should be stored in a cool, dry place away from heat and direct sunlight. In case of a spill, use appropriate absorbent materials and ensure proper disposal according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
Contact Information
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