Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate

Basic Information

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CAS Number

850429-60-6

Molecular Formula

C5H5BrN2O2S

Molecular Weight

237.08 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

Agricultural Chemicals Pesticides Herbicides

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Melting Point

157-159

Boiling Point

349.3°C at 760 mmHg

SMILES

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COC(=O)c1nc(N)sc1Br

InChI

InChI=1S/C5H5BrN2O2S/c1-10-4(9)2-3(6)11-5(7)8-2/h1H3,(H2,7,8)

InChIKey

KVUHCAXYWHQFLW-UHFFFAOYSA-N

LogP

1.2744

Topological Polar Surface Area

65.21 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

169

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious 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 2-amino-5-bromothiazole-4-carboxylate
2-Amino-5-Bromothiazole-4-Carboxylic Acid Ethyl Ester
2-Amino-5-bromothiazole-4-carboxylic acid methyl ester
2-Amino-5-bromo-4-thiazolecarboxylic acid methyl ester
methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate

MDL Number

MFCD00137990

Customs Code

2934100090

FAQ

What is Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6)?

Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) is an organic compound with the molecular formula C8H7BrN3O2S. It is a colorless to white crystalline solid with a pungent odor. This compound is used primarily in pharmaceutical and chemical synthesis applications due to its unique functional groups.

What are the main uses of Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6)?

Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) is mainly used in the pharmaceutical industry for intermediate synthesis and as a reagent in various chemical reactions. It is also used in research for developing new drug candidates and in analytical chemistry for its reactivity with certain functional groups.

Is Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) safe?

Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) is generally considered safe when handled with appropriate precautions. However, it should be stored away from heat and open flames. Skin contact and inhalation should be avoided, and proper ventilation is recommended. Always follow safety guidelines provided by the manufacturer for handling and use.

How should Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) be stored?

Methyl 2-amino-5-bromo-1,3-thiazole-4-carboxylate (CAS: 850429-60-6) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should be below 25°C, and the container should be clearly labeled with hazard warnings and the CAS number. Handle with care to avoid spills or contamination.