Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate

Basic Information

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CAS Number

606093-58-7

Molecular Formula

C14H12FN3O4

Molecular Weight

305.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Density

1.441±0.06 g/cm3 (20 ºC 760 Torr),

Solubility

Insuluble (1.7E-3 g/L) (25 ºC),

SMILES

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COC(=O)c1cc(c(c(c1Nc2ccccc2)F)N)[N+](=O)[O-]

InChI

InChI=1S/C14H12FN3O4/c1-22-14(19)9-7-10(18(20)21)12(16)11(15)13(9)17-8-5-3-2-4-6-8/h2-7,17H,16H2,1H3

InChIKey

JQUIVIJMSGIEPL-UHFFFAOYSA-N

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H320 Causes eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Methyl 4-amino-3-fluoro-5-nitro-2-(phenylamino)benzoate
Benzoicacid, 4-amino-3-fluoro-5-nitro-2-(phenylamino)-, methyl ester
Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate
benzoic a<wbr>
LogP
Methyl-4-amino-2-anilino-3-fluor-5-nitrobenzoat

MDL Number

MFCD09909911

FAQ

What regulatory guidelines apply to Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7)?

Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7) falls under several regulatory guidelines. Under the GHS (Global Harmonized System of Classification and Labeling of Chemicals), it may require hazard communication labels and safety data sheets. For EU manufacturers, distributors, and importers, it must comply with REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) regulations. In the US, the FDA may regulate it for specific uses, and the EPA may require it to be registered under certain conditions. Always consult the latest regulatory documents for specific requirements.

Are there alternatives to Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7) in synthesis?

There are alternative reagents and compounds that can be used in synthesis as substitutes for Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7). For example, Methyl 4-amino-2-anilino-3-chloro-5-nitrobenzoate and Methyl 4-amino-2-anilino-3-methyl-5-nitrobenzoate are analogs that can be used in similar reactions. Additionally, isomers and other derivatives of the compound can also serve as viable alternatives, depending on the specific application.

What is the market or research trend for Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7)?

The market for Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7) is closely linked with advances in research, particularly in the pharmaceutical and chemical industries. There is a growing interest in exploring its potential applications in drug synthesis. Recent trends indicate an increasing focus on developing more efficient synthesis methods and exploring its use in less toxic formulations. The price trends and demand for this compound are expected to continue growing as more applications are discovered.

How should waste containing Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7) be handled?

Waste containing Methyl 4-amino-2-anilino-3-fluoro-5-nitrobenzoate (CAS: 606093-58-7) should be managed according to local waste management regulations. Typically, it is advisable to collect waste liquids in appropriate containers and store them in a designated area with proper ventilation. For disposal, it may be necessary to incinerate the waste or arrange for professional waste disposal services. Environmental precautions, such as avoiding contact with water sources and ensuring proper containment to prevent spillage, are crucial to prevent contamination and ensure safety.