4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one

Basic Information

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CAS Number

64359-81-5

Molecular Formula

C11H17Cl2NOS

Molecular Weight

282.24 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

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

40.0 to 44.0 deg-C

Boiling Point

322.6°C at 760 mmHg

SMILES

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CCCCCCCCN1SC(Cl)=C(Cl)C1=O

InChI

InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3

InChIKey

PORQOHRXAJJKGK-UHFFFAOYSA-N

LogP

4.577100000000004

Topological Polar Surface Area

22.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

281

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H317 May cause an allergic skin reaction
Sensitization, Skin

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H410 Very toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 9 Class 9

Synonyms & References

English

4,5-Dichloro-2-octylisothiazol-3(2H)-one
DCOIT
4,5-DICHLORO-2-N-OCTYL-3(2H)-ISOTHIAZOLONE
4,5-dichloro-2-octyl-3(2h)-isothiazolone
4,5-Dichloro-2-octyl-isothiazolone
Kathon 287T
kathon 930
Dichloro-2-n-octyl-3(2H)-isothiazolone
duracide l
4,5-dichloro-2n-octyl-3-isothiazolone
4,5-dichloro-2-n-octyl-3-isothiazolone
4,5-Dichloro-2-n-octyl-4-isothiazolin-3-one
4,5-DICHLORO-2-N-OCTYL-4-ISOTHIAZOLIN-3-ONE(DCOIT)
DCOIT-10
DCOIT-20
DCOIT-97
4,5-dichloro-2-n-octyl-3-isothiazolone(DCOIT)
4,5-dichloro-2-octyl-1,2-thiazol-3-one
MIT 1.5
3(2H)-Isothiazolone, 4,5-dichloro-2-octyl-
Caswell No. 314B
C11H17Cl2NOS
4,5-Dichloro-2-octyl-2H-isothiazol-3-one
EPA Pesticide Chemical Code 128101
HCY9Q844W2
POR

MDL Number

MFCD04034673

Customs Code

2934999090

FAQ

What is 4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one (CAS: 64359-81-5)?

4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one is a thiazole derivative with the chemical formula C11H17Cl2NS. It is a heterocyclic organic compound characterized by a sulfur atom in its ring structure. The molecule contains two chlorine atoms and an octyl group, making it useful in various chemical applications. It is typically a solid at room temperature and has moderate solubility in organic solvents.

What are the main uses of 4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one (CAS: 64359-81-5)?

4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one is primarily used in pharmaceutical research as a potential intermediate for drug development. It also finds applications in organic synthesis and as a component in agrochemicals. Due to its chemical versatility, it is valuable in research settings for creating derivatives with specific biological activities.

Is 4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one (CAS: 64359-81-5) safe?

4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one should be handled with appropriate safety measures. It may have toxic effects if inhaled, ingested, or absorbed through the skin. Protective equipment such as gloves, goggles, and a lab coat is recommended. Safety standards suggest working in a well-ventilated area and following standard chemical handling protocols to ensure safe use.

How should 4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one (CAS: 64359-81-5) be stored?

4,5-Dichloro-2-octyl-1,2-thiazol-3(2H)-one should be stored in a cool, dry, and dark place to maintain stability. It is recommended to keep it in a sealed container away from moisture and light exposure. Storage at temperatures below 25°C is ideal, and it should be kept in a well-ventilated area to prevent potential hazards.