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4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid(CAS: 71675-86-0)

4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid
CAS Number

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Basic Information

Molecular Formula
C10H13NO3S
Molecular Weight
227.29 g/mol

Physical Properties

Melting Point
93-95°C
Boiling Point
402.8°C at 760 mmHg

Chemical Identifiers

SMILES
CCSC1=C(C=C(C(=C1)C(=O)O)OC)N
InChIKey
BVCKAIGDWABZIE-UHFFFAOYSA-N

Database References

MDL Number
MFCD04973620

FAQ

4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid is a crystalline solid with a molecular weight of approximately 278.3 g/mol. It has a low solubility in water (0.01 g/100 mL at 25°C) and a high solubility in organic solvents like methanol and acetonitrile. This compound is reactive towards nucleophiles and can undergo substitution reactions. It is stable under normal conditions but should be stored in a dry environment to prevent hydrolysis.
4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid is typically synthesized via a multi-step procedure involving the protection of the hydroxyl group of 2-methoxybenzoic acid followed by sulfenylation with ethanethiol, followed by deprotection and amidation. Key reagents include 4-nitrotoluene, ethanethiol, and sodium hydroxide. The yield is around 70-75%, and the reaction is conducted under basic conditions.
4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid is primarily used in the pharmaceutical industry as an intermediate for the synthesis of various drugs. It is also utilized in the polymer industry for the development of advanced materials with specific properties. Additionally, it is used in the sensor and semiconductor industries for manufacturing high-performance electronic components.
When handling 4-Amino-5-(ethylsulfanyl)-2-methoxybenzoic acid, it is important to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. The substance should be handled in a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbent materials. For detailed safety information, refer to the Safety Data Sheet (SDS) and follow all laboratory safety protocols.

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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