Methyl 3-amino-5-bromo-4-methylbenzoate

Basic Information

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CAS Number

223519-11-7

Molecular Formula

C9H10BrNO2

Molecular Weight

244.09 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CC1=C(C=C(C=C1Br)C(=O)OC)N

InChI

InChI=1S/C9H10BrNO2/c1-5-7(10)3-6(4-8(5)11)9(12)13-2/h3-4H,11H2,1-2H3

InChIKey

BXVMWNWKILQIHB-UHFFFAOYSA-N

LogP

2.1263199999999998

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

198

Synonyms & References

English

SCHEMBL18585192
CS-0061185
EN300-1693505
Methyl 3-amino-5-bromo-4-methylbenzoate
5-AMINO-3-BROMO-4-METHYL-1-CARBOXYLIC ACID METHYL ESTER
3-Amino-5-bromo-4-methyl-benzoic acid methyl ester
DTXSID60646423
YIA51911
MFCD07773038
FT-0686829
W17288
223519-11-7
DS-6778
AKOS015996062
3-amino-5-bromo-4-methylBenzoic acid methyl ester
5-Amino-3-bromo-4-methyl-1-benzoic acid methyl ester
5-Amino-3-bromo-4-methyl-1-benzoic acidmethyl ester
Benzoic acid,3-amino-5-bromo-4-methyl-, methyl ester
5-Amino-3-bromo-4-methyl-1-benzoic acid methyl ester
AK139831

MDL Number

MFCD07773038

Customs Code

2922499990

FAQ

What regulatory guidelines apply to Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7)?

Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7) falls under the scope of various regulatory guidelines. It is classified according to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS). For production and distribution, it must comply with REACH regulations for identifying and managing the risks associated with its use. Additionally, the FDA and EPA have specific requirements for handling and disposing of this chemical to ensure public and environmental safety.

Are there alternatives to Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7) in synthesis?

In the synthesis of similar compounds, there are several alternatives to Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7). These include methyl 3-amino-4-methylbenzoate and methyl 5-bromo-4-methylbenzoate, which can serve as viable substitutes. Other alternative reagents might include bromobenzene or similar aromatic compounds, depending on the specific desired properties of the final product.

What is the market or research trend for Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7)?

The market for Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7) is driven by its applications in pharmaceuticals and research. Recent trends indicate growing interest in its use as an intermediate in drug synthesis and as a component in research studies focused on chemical biology and medicinal chemistry. The demand is likely to increase with advancements in these fields and the development of new applications.

How should waste containing Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7) be handled?

Waste containing Methyl 3-amino-5-bromo-4-methylbenzoate (CAS: 223519-11-7) should be collected in appropriate containers and stored separately to prevent contamination. Professional waste disposal services should be used to ensure proper incineration or other environmentally safe disposal methods. Environmental protection precautions should include the use of personal protective equipment and adherence to local and national waste management regulations to minimize environmental impact.