4-Bromo-6-chloro-1H-indole

Basic Information

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CAS Number

885519-23-3

Molecular Formula

C8H5BrClN

Molecular Weight

230.49 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

348.1±22.0°C at 760 mmHg

Density

1.772±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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C1=CNC2=C1C(=CC(=C2)Cl)Br

InChI

InChI=1S/C8H5BrClN/c9-7-3-5(10)4-8-6(7)1-2-11-8/h1-4,11H

InChIKey

FWMOVLKMGUEKOT-UHFFFAOYSA-N

LogP

3.583800000000001

Topological Polar Surface Area

15.79 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

153

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

4-Bromo-6-chloro-1H-indole
1H-Indole, 4-broMo-6-chloro-
4-Bromo-6-chloroindole
AK133022
4-bromo-6-chloro-1H indazole
SB15272
FCH1385655
AX8243910
ST24043456
4-bromo-6-chloro-1H-indole
4-Bromo-6-chloro-1H-indole (ACI)
AKOS022171761
SCHEMBL1020339
DS-7117
DA-39835
CS-W006412
SY109134
885519-23-3
MFCD07781364
DTXSID90646178

MDL Number

MFCD07781364

FAQ

What regulatory guidelines apply to 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3)?

4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) falls under various regulatory guidelines including GHS (Global Harmonized System of Classification and Labeling of Chemicals), REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals), and FDA/EPA requirements. Suppliers and handlers must ensure compliance with these regulations for classification, labeling, and safe handling practices.

Are there alternatives to 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) in synthesis?

Alternatives to 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) include various indole derivatives such as 4-bromo-1H-indole and 6-chloro-1H-indole, which can serve as precursors in synthetic pathways. Other substitutes may include brominated or chlorinated indoles with different substituent positions, depending on the desired chemical properties and reactivity.

What is the market or research trend for 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3)?

The market for 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) is characterized by increasing research interest in its use as a building block for pharmaceuticals and agrochemicals. Recent trends indicate a growing focus on its potential applications in medicinal chemistry, particularly in the synthesis of bioactive compounds. Additionally, there is a rising demand for environmentally friendly synthetic methods, influencing the research and development of alternative approaches.

How should waste containing 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) be handled?

Waste containing 4-Bromo-6-chloro-1H-indole (CAS: 885519-23-3) should be collected in appropriate containers and handled according to local and international environmental regulations. Proper disposal methods include incineration or professional waste disposal services. Handlers should ensure that waste is managed in a manner that minimizes environmental impact and complies with safety and regulatory requirements.