7-Chloroisatin

Basic Information

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CAS Number

7477-63-6

Molecular Formula

C8H4ClNO2

Molecular Weight

181.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

Physical State

Light-red to Brown Solid

Melting Point

187-191 °C

Density

1.519

Refractive Index

1.626

SMILES

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C1=CC2=C(C(=C1)Cl)NC(=O)C2=O

InChI

InChI=1S/C8H4ClNO2/c9-5-3-1-2-4-6(5)10-8(12)7(4)11/h1-3H,(H,10,11,12)

InChIKey

MPLXQMMMGDYXIT-UHFFFAOYSA-N

LogP

1.4747999999999997

Topological Polar Surface Area

46.17 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

241

Safety Information

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GHS Hazard Pictograms

H302

H315

H319

H335

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

C2840
FS-2168
7-chloroindoline-2,3-dione
MFCD00022796
FT-0621373
PD183095
CCB49FJV8D
NSC400868
SR-01000550632
7-Chloroisatin, 97%
7477-63-6
7-chloro-2,3-dihydro-1H-indole-2,3-dione
NSC-400868
CS-W002129
7-chloro-indoline-2,3-dione
DTXSID60322295
7-chloro isatin
SCHEMBL1247382
SY008499
A9563
7-chloro-2,3-indolinedione
Z57127979
CHEMBL222190
BDBM22823
EN300-49324
7-chloro-1H-indole-2,3-dione
SR-01000550632-1
7-Chloroindole-2,3-dione
MLS003171490
AC-24974
Isatin-based compound, 43

MDL Number

MFCD00022796

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 7-Chloroisatin (CAS: 7477-63-6)?

7-Chloroisatin (CAS: 7477-63-6) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a hazardous substance due to its potential for skin irritation and sensitization. In the European Union, it must comply with REACH regulations, which require companies to register substances above a certain tonnage threshold and provide safety data sheets. The U.S. FDA and EPA have specific labeling and reporting requirements for chemicals used in pharmaceuticals and environmental releases, respectively.

Are there alternatives to 7-Chloroisatin (CAS: 7477-63-6) in synthesis?

There are alternative reagents and compounds that can be used in the synthesis of bioactive compounds. For instance, 5-Chloroisatin or derivatives such as 4-Chloroisatin can serve as analogous starting materials. Other alternatives include using other aromatic amines like benzaldehyde or aniline, which can be substituted and modified to achieve similar or enhanced properties in the target compounds.

What is the market or research trend for 7-Chloroisatin (CAS: 7477-63-6)?

The market for 7-Chloroisatin (CAS: 7477-63-6) is growing due to its potential in anti-inflammatory and anti-cancer research. Recent studies have shown promising results in inhibiting certain enzyme activities, making it a focus in drug discovery. However, the research trend is also shifting towards more sustainable and less toxic alternatives, driving the exploration of natural and synthetic isatin analogs.

How should waste containing 7-Chloroisatin (CAS: 7477-63-6) be handled?

Waste containing 7-Chloroisatin (CAS: 7477-63-6) should be collected in appropriate containers and stored in a well-ventilated area away from ignition sources. For incineration, ensure it is done in a controlled and properly permitted facility to minimize environmental impact. Professional waste disposal services are recommended to handle and dispose of the waste safely, adhering to local environmental regulations and guidelines.