2-Chloro-4,6-dimethyl-1,3-benzothiazole

Basic Information

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CAS Number

80689-35-6

Molecular Formula

C9H8ClNS

Molecular Weight

197.69 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

287 °C at 760 mmHg

Density

1.311

Flash Point

127.4 °C

SMILES

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Cc1cc(C)c2nc(Cl)sc2c1

InChI

InChI=1S/C9H8ClNS/c1-5-3-6(2)8-7(4-5)12-9(10)11-8/h3-4H,1-2H3

InChIKey

DGUINEVXAOBICO-UHFFFAOYSA-N

LogP

3.5665400000000016

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Synonyms & References

English

2-Chloro-4,6-dimethylbenzo[d]thiazole
2-chloro-4,6-dimethyl-1,3-benzothiazole
2-Chloro-4,6-dimethylbenzothiazole
Benzothiazole,2-chloro-4,6-dimethyl-
F1910-0026

MDL Number

MFCD04971829

Customs Code

2934200090

FAQ

What is 2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6)?

2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) is a synthetic organic compound with the molecular formula C9H10ClN2S. It is characterized by its yellow crystalline appearance and is used in various applications due to its unique chemical properties.

What are the main uses of 2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6)?

2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) is primarily used as a chemical intermediate in the synthesis of dyes and pharmaceuticals. It also finds use in the production of certain crop protection agents and as a stabilizer in rubber compounds.

Is 2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) safe?

2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) is generally considered safe when handled with proper precautions. However, it is important to use appropriate personal protective equipment (PPE) and to follow safety guidelines to minimize exposure. Exposure to eyes, skin, and inhalation should be avoided.

How should 2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) be stored?

2-Chloro-4,6-dimethyl-1,3-benzothiazole (CAS: 80689-35-6) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly closed container made of appropriate materials, such as glass or plastic, to prevent contamination and degradation. The storage area should be well-ventilated to minimize the risk of inhalation exposure.