Methyl 7-aminobenzo[b]thiophene-2-carboxylate

Basic Information

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CAS Number

616238-78-9

Molecular Formula

C10H9NO2S

Molecular Weight

207.25 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

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

382.8°C at 760 mmHg

Density

1.352

Flash Point

185.3°C

Refractive Index

1.688

SMILES

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COC(=O)C1=CC2=C(S1)C(=CC=C2)N

InChI

InChI=1S/C10H9NO2S/c1-13-10(12)8-5-6-3-2-4-7(11)9(6)14-8/h2-5H,11H2,1H3

InChIKey

OWASVDSNOKBQKG-UHFFFAOYSA-N

LogP

2.2701

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

234

Synonyms & References

English

Methyl 7-aminobenzo[b]thiophene-2-carboxylate
methyl 7-amino-1-benzothiophene-2-carboxylate
LogP
Methyl-7-amino-1-benzothiophen-2-carboxylat
Benzo[b]thiophene-2-carboxylic acid, 7-amino-, methyl ester (9CI)
OWASVDSNOKBQKG-UHFFFAOYSA-N
AK149987
7-amino-benzo[b]thiophene-2-carboxylic acid methyl ester
Z2217316132
Benzo[b]thiophene-2-carboxylic acid, 7-amino-, methyl ester
methyl 7-aminobenzothiophene-2-carboxylate
O11972
DB-431630
Z1269214255
Methyl7-aminobenzo[b]thiophene-2-carboxylate
AKOS022189528
DTXSID10666535
Benzo[b]thiophene-2-carboxylic acid,7-amino-,methyl ester(9ci)
CS-0148778
MFCD13180847
DS-9249
616238-78-9
EN300-222654
Methyl 7-amino-1-benzothiophene-2-carboxylate
SCHEMBL3258140

MDL Number

MFCD13180847

FAQ

What regulatory guidelines apply to Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9)?

Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9) falls under various regulatory guidelines. It is classified under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) as a skin and eye irritant. Additionally, manufacturers and importers must comply with the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulations in the EU. In the USA, it must adhere to the Toxic Substances Control Act (TSCA) and Environmental Protection Agency (EPA) guidelines.

Are there alternatives to Methyl 7-aminobenzo[b]thiophene-2-carboxylate in synthesis?

Several alternatives to Methyl 7-aminobenzo[b]thiophene-2-carboxylate in synthesis include analogous compounds like 4-aminobenzo[b]thiophene-2-carboxylic acid and related derivatives. Common alternative reagents include thiols and amines. These alternatives can provide similar functionalities and may offer better reactivity or solubility in specific synthesis conditions.

What is the market or research trend for Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9)?

The market for Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9) is growing due to its application in pharmaceuticals and materials science. Research trends focus on its use as a precursor in drug design and as a building block for polymer synthesis. Increasing demand is driven by the development of novel pharmaceutical compounds and advanced materials with improved properties.

How should waste containing Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9) be handled?

Waste containing Methyl 7-aminobenzo[b]thiophene-2-carboxylate (CAS: 616238-78-9) should be handled carefully to ensure environmental safety. Collect waste in appropriate containers and follow local regulations for hazardous waste disposal. Incineration is a common method, but professional waste disposal services are recommended. Always ensure proper personal protective equipment is used and follow all safety precautions to prevent exposure and environmental contamination.