3,6-Dibromo-1H-indazole

Basic Information

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CAS Number

885521-84-6

Molecular Formula

C7H4Br2N2

Molecular Weight

275.93 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

SMILES

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C1=CC2=C(NN=C2C=C1Br)Br

InChI

InChI=1S/C7H4Br2N2/c8-4-1-2-5-6(3-4)10-11-7(5)9/h1-3H,(H,10,11)

InChIKey

UZVUZQPJNJJVJF-UHFFFAOYSA-N

LogP

3.087900000000001

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

153

Synonyms & References

English

3,6-Dibromo-1H-indazole
1H-INDAZOLE,3,6-DIBROMO-
3,6-Dibromo (1H)indazole
3,6-dibromo-2H-indazole
1H-INDAZOLE,3,6-DIBROMO
3,6-DIBROMO-INDAZOLE
3,6-Dibromo-1H-indazole (ACI)
3,6-Dibromo-2H-indazole
MB04899
DB-077985
885521-84-6
MFCD07781598
DTXSID80646268
AKOS016004081
CS-0319240
G82790
3,6-Dibromo(1H)indazole

MDL Number

MFCD07781598

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 3,6-Dibromo-1H-indazole (CAS: 885521-84-6)?

3,6-Dibromo-1H-indazole (CAS: 885521-84-6) must comply with the Globally Harmonized System of Classification and Labeling of Chemicals (GHS) for hazardous substances. It is also subject to the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulations in the European Union. In the United States, it falls under the purview of the Food and Drug Administration (FDA) and the Environmental Protection Agency (EPA) for safety and environmental protection guidelines.

Are there alternatives to 3,6-Dibromo-1H-indazole (CAS: 885521-84-6) in synthesis?

There are several alternatives to 3,6-Dibromo-1H-indazole (CAS: 885521-84-6) in synthesis, such as 1H-indazole and its brominated analogs with different substituents. Common alternative reagents include bromine and other halogenating agents like N-bromosuccinimide (NBS). These alternatives can offer similar functionalities but with varying reactivity and toxicity profiles.

What is the market or research trend for 3,6-Dibromo-1H-indazole (CAS: 885521-84-6)?

The market for 3,6-Dibromo-1H-indazole (CAS: 885521-84-6) is growing due to its use in pharmaceuticals and materials science. Research trends focus on its application in drug discovery, particularly in antiviral and anticancer agents. Additionally, there is increasing interest in its use as a building block in heterocyclic synthesis and as a potential material for electronic and optoelectronic applications.

How should waste containing 3,6-Dibromo-1H-indazole (CAS: 885521-84-6) be handled?

Waste containing 3,6-Dibromo-1H-indazole (CAS: 885521-84-6) should be collected in appropriate containers and stored in a cool, well-ventilated area away from incompatible substances. Proper disposal should involve incineration or professional chemical waste disposal services. Environmental protection should be ensured by following local regulations and guidelines to minimize environmental impact. Safe handling and disposal procedures should be strictly followed to prevent contamination and exposure.