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7-(3-Amino-1-pyrrolidinyl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 4-methylbenzenesulfonate (1:1)(CAS: 115964-29-9)

7-(3-Amino-1-pyrrolidinyl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 4-methylbenzenesulfonate (1:1)
CAS Number

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Basic Information

Molecular Formula
C26H23F3N4O6S
Molecular Weight
576.55 g/mol

Physical Properties

Melting Point
251-252°C
Boiling Point
614.4°Cat760mmHg
Density
1.558
Flash Point
614.4°Cat760mmHg

Chemical Identifiers

SMILES
CC1=CC=C(C=C1)S(=O)(=O)O.C1CN(CC1N)C2=C(C=C3C(=O)C(=CN(C3=N2)C4=C(C=C(C=C4)F)F)C(=O)O)F
InChIKey
CSSQVOKOWWIUCX-UHFFFAOYSA-N

Database References

MDL Number
MFCD01711971

FAQ

This compound has a crystalline form with a molecular weight of approximately 614.74 g/mol. It exhibits good solubility in organic solvents like DMSO and moderate solubility in water. The compound is relatively stable under normal conditions but can react with strong bases and acids. It is typically used in pharmaceutical applications due to its reactivity.
This compound is typically synthesized through a multi-step process involving the condensation of key intermediates. The synthesis involves the use of common reagents such as pyridine and dicyclohexylcarbodiimide (DCC). The yield is generally around 70%, and the process ensures high selectivity for the desired product.
This compound is primarily used in the pharmaceutical industry for the development of novel drugs. It is also of interest in the semiconductor industry for use in electronic materials and doping agents. Additionally, it has potential applications in the polymer industry for its unique chemical properties.
Proper safety precautions must be taken when handling this compound. Always wear appropriate personal protective equipment (PPE) such as gloves, lab coat, and safety goggles. Work within a fume hood to minimize exposure. In the event of a spill, neutralize the area with appropriate chemicals and clean up according to standard safety protocols. Refer to the Material Safety Data Sheet (MSDS) 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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