4,6-Dichloro-1,3-benzothiazol-2(3H)-one

Basic Information

View in Editor

CAS Number

87553-88-6

Molecular Formula

C7H3Cl2NOS

Molecular Weight

220.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

View in Editor

C1=C(C=C(C2=C1SC(=O)N2)Cl)Cl

InChI

InChI=1S/C7H3Cl2NOS/c8-3-1-4(9)6-5(2-3)12-7(11)10-6/h1-2H,(H,10,11)

InChIKey

FAJYYCLIPJHGRV-UHFFFAOYSA-N

LogP

2.8964000000000008

Topological Polar Surface Area

32.86 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

214

Synonyms & References

English

AKOS016005505
4,6-Dichloro-2(3H)-benzothiazolone
2(3H)-Benzothiazolone,4,6-dichloro-(9CI)
4,6-dichloro-2,3-dihydro-1,3-benzothiazol-2-one
4,6-Dichloro-1,3-benzothiazol-2(3H)-one
DS-18329
A842259
87553-88-6
DTXSID40663294
4,6-Dichlorobenzo[d]thiazol-2(3H)-one
4,6-dichloro-1,3-benzothiazol-2-ol
4,6-Dichloro-2(3H)-benzothiazolone;4,6-Dichlorobenzo[d]thiazol-2(3H)-one
FT-0688542
4,6-dichloro-3H-1,3-benzothiazol-2-one

MDL Number

MFCD09748593

FAQ

What is 4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6)?

4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) is a yellow solid organic compound. It has a molecular formula of C8H4Cl2NOS and a molecular weight of approximately 228.03 g/mol. This compound is characterized by its aromatic and chlorinated benzothiazole structure.

What are the main uses of 4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6)?

4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) is primarily used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is also used in research and development for its unique chemical properties.

Is 4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) safe?

4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) is generally considered safe when handled with appropriate precautions. It is important to use personal protective equipment, such as gloves and goggles, and ensure good ventilation during handling. It should not come into contact with water or air, and proper storage and disposal practices should be followed.

How should 4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) be stored?

4,6-Dichloro-1,3-benzothiazol-2(3H)-one (CAS: 87553-88-6) should be stored in a cool, dry place, away from direct sunlight and moisture. It should be kept in a tightly sealed container to prevent degradation. Temperature should be maintained below 25°C, and the storage area should be well-ventilated to avoid the risk of explosion or reaction with other substances.