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Methyl 2,4,5-triamino-3-fluorobenzoate(CAS: 918321-27-4)

Methyl 2,4,5-triamino-3-fluorobenzoate
CAS Number

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Basic Information

Molecular Formula
C8H10FN3O2
Molecular Weight
199.18 g/mol

Chemical Identifiers

SMILES
COC(=O)C1=CC(=C(C(=C1N)F)N)N
InChIKey
RADQVYGLIBGGAP-UHFFFAOYSA-N

Database References

MDL Number
MFCD20725583

FAQ

Methyl 2,4,5-triamino-3-fluorobenzoate is a white crystalline solid with a molecular weight of approximately 229.21 g/mol. It has a solubility of about 6.5 g/L in water and is practically insoluble in most organic solvents. Chemically, it is highly reactive due to the amine groups and the fluorine substituent, making it prone to nucleophilic substitution and other reactions.
Methyl 2,4,5-triamino-3-fluorobenzoate is typically synthesized through a multi-step process involving the protection of the carboxylic acid group, followed by the introduction of the amine groups and fluorination. Commonly, this involves the use of protecting agents like tert-butyldimethylsilyl chloride and subsequent deprotection using fluoride sources under controlled conditions.
Methyl 2,4,5-triamino-3-fluorobenzoate finds applications in the pharmaceutical industry, particularly in the development of novel drugs and intermediates. It is also used in the synthesis of certain polymers and sensors due to its unique chemical properties.
When handling Methyl 2,4,5-triamino-3-fluorobenzoate, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be handled with caution using appropriate spill kits, and the Material Safety Data Sheet (MSDS) should always be referenced for detailed safety information.

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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