7-Chloro-1H-indole-3-carboxylic acid

Basic Information

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CAS Number

86153-24-4

Molecular Formula

C9H6ClNO2

Molecular Weight

195.61 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

Physical State

Pale-yellow to Yellow-brown Solid

Boiling Point

449.7°C at 760 mmHg

Density

1.548

Flash Point

225.8°C

Refractive Index

1.728

SMILES

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OC(=O)c1c[nH]c2c(Cl)cccc12

InChI

InChI=1S/C9H6ClNO2/c10-7-3-1-2-5-6(9(12)13)4-11-8(5)7/h1-4,11H,(H,12,13)

InChIKey

DBCJWTBYVXEBJY-UHFFFAOYSA-N

LogP

2.5195000000000007

Topological Polar Surface Area

53.089999999999996 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

222

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

7-Chloro-1H-indole-3-carboxylic acid
1H-INDOLE-3-CARBOXYLIC ACID,7-CHLORO
1H-Indole-3-carboxylicacid, 7-chloro-
7-Chloroindole-3-carboxylic acid
1H-Indole-3-carboxylic acid, 7-chloro-
7-Chloro-1H-indole-3-carboxylicacid
DBCJWTBYVXEBJY-UHFFFAOYSA-N
BCP08387
SB14993
SY058802
ST2419034
AB0027062
W8850
A102
7-chloro-1H-indole-3-carboxylic acid

MDL Number

MFCD07369968

FAQ

What regulatory guidelines apply to 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4)?

7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) falls under the purview of several regulatory frameworks. It is classified under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a hazardous chemical. For European Union manufacturers and importers, REACH regulation applies, requiring registration of substances above one tonne per year. In the USA, the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) have specific regulations for handling and disposing of hazardous chemicals. It is crucial to consult the latest regulatory guidelines for proper handling and storage.

Are there alternatives to 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) in synthesis?

Alternative reagents to 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) include other substituted indoles or derivatives. For example, 7-bromo-1H-indole-3-carboxylic acid or 7-iodo-1H-indole-3-carboxylic acid can be used as substitutes. Researchers often explore isomers or analogs such as 1H-indole-3-carboxylic acid or 2-chloro-1H-indole-3-carboxylic acid depending on the specific chemical requirements of the synthesis. These alternatives can provide similar functional groups but with different chemical properties, making them useful in various synthetic strategies.

What is the market or research trend for 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4)?

The market for 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) is driven by its application in pharmaceutical and chemical research. Recent research trends indicate increased interest in indole derivatives for drug discovery due to their potential in treating various diseases, including cancer and neurological disorders. Market analysis shows a steady demand for these compounds, particularly in academia and biotechnology companies. However, due to its hazardous nature, there is also a growing emphasis on sustainable and safer synthetic routes.

How should waste containing 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) be handled?

Waste containing 7-Chloro-1H-indole-3-carboxylic acid (CAS: 86153-24-4) should be collected in appropriate, leak-proof containers and stored under controlled conditions to prevent environmental contamination. Proper disposal methods include incineration, which is a common practice for hazardous organic waste, or professional waste disposal services that adhere to environmental protection standards. It is essential to follow local and international regulations for waste management and to ensure that disposal methods are safe and environmentally friendly. Always consult with environmental and safety experts for guidance on specific disposal needs.