Methyl 4-bromo-3-hydroxythiophene-2-carboxylate

Basic Information

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CAS Number

95201-93-7

Molecular Formula

C6H5BrO3S

Molecular Weight

237.07 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

86 ºC

Boiling Point

247.9±35.0 ºC (760 Torr),

Density

1.803±0.06 g/cm3 (20 ºC 760 Torr),

Water Solubility

Sparingly Soluble in water 0.95 g/L @ 25°C.

Flash Point

103.7±25.9 ºC,

SMILES

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COC(=O)C1=C(C(=CS1)Br)O

InChI

InChI=1S/C6H5BrO3S/c1-10-6(9)5-4(8)3(7)2-11-5/h2,8H,1H3

InChIKey

UFTXASQYKJFRKI-UHFFFAOYSA-N

LogP

2.0027999999999997

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

164

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

Methyl 4-bromo-3-hydroxythiophene-2-carboxylate
4-Bromo-3-hydroxy-2-(methoxycarbonyl)thiophene
4-Bromo-3-hydroxythiophene-2-carboxylic acid methyl ester
Methyl 3-hydroxy-4-bromo-2-thiophenecarboxylate
Methyl 4-bromo-3-hydroxy-2-thiophenecarboxylate
methyl 4-bromo-3-hydroxythiophene-2-carboxylate
SCHEMBL1760863
TS-03322
BP-10143
95201-93-7
UFTXASQYKJFRKI-UHFFFAOYSA-N
BCP06815
AKOS005067760
CS-0150885
Methyl-3-hydroxy-4-bromo-2-thiophenecarboxylate
CCG-240049
VDA20193
HMS552O08
4-bromo-3-hydroxythiophene-2-carboxylic acid methyl ester
2-Thiophenecarboxylic acid, 4-bromo-3-hydroxy-, methyl ester
MFCD00052081
DB-057565
methyl4-bromo-3-hydroxythiophene-2-carboxylate
SY025712
(4-bromo-3-oxo-2-thienylidene)-methoxy-methanolate
Methyl-4-bromo-3-hydroxy-2-thiophenecarboxylate
DTXSID30380589
Maybridge1_004012
2-Thiophenecarboxylicacid,4-bromo-3-hydroxy-,methyl ester

MDL Number

MFCD00052081

Customs Code

2934999090

FAQ

What regulatory guidelines apply to Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7)?

Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) falls under the regulatory guidelines of the GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for classification and labeling. In the European Union, it is subject to REACH regulations, which require manufacturers and importers to register substances with the European Chemicals Agency. The FDA and EPA may also have specific requirements for this compound, especially if it is used in pharmaceuticals or environmental applications.

Are there alternatives to Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) in synthesis?

Yes, there are alternatives to Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) in synthesis. Common alternatives include other brominated thiophene derivatives such as 3-bromo-2-hydroxythiophene or 4-bromo-2-hydroxythiophene. Isomers and analogs of this compound can also serve as viable alternatives depending on the specific synthetic needs.

What is the market or research trend for Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7)?

The market for Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) is currently growing, driven by its applications in pharmaceuticals, materials science, and research. Emerging trends include its use in developing new drugs and functional materials. Research is focusing on understanding its properties and exploring its potential in applications such as polymer synthesis and sensor technology.

How should waste containing Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) be handled?

Waste containing Methyl 4-bromo-3-hydroxythiophene-2-carboxylate (CAS: 95201-93-7) should be collected in appropriate, labeled containers and disposed of according to local regulations. Incineration can be an effective method for waste disposal, but it should be conducted in a controlled environment to minimize environmental impact. Professional waste disposal services are recommended to ensure proper handling and disposal, including the use of appropriate protective equipment and adherence to safety protocols.