7-Iodo[1,2,4]triazolo[4,3-a]pyridine

Basic Information

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CAS Number

864866-44-4

Molecular Formula

C6H4IN3

Molecular Weight

245.02 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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IC1=CC2=NN=CN2C=C1

InChI

InChI=1S/C6H4IN3/c7-5-1-2-10-4-8-9-6(10)3-5/h1-4H

InChIKey

KQTSOSULAYFHBH-UHFFFAOYSA-N

LogP

1.3339

Topological Polar Surface Area

30.19 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

130

Synonyms & References

English

7-碘(1,2,4)呔唑-4,3A-吡啶
7-Iodo-[1,2,4]triazolo[4,3-a]pyridine
1,2,4-Triazolo[4,3-a]pyridine, 7-iodo-
s11549
7-iodo-[1,2,4]triazolo[4,3-a]pyridine

MDL Number

MFCD27921215

FAQ

What are the physical and chemical properties of 7-Iodo[1,2,4]triazolo[4,3-a]pyridine (CAS: 864866-44-4)?

7-Iodo[1,2,4]triazolo[4,3-a]pyridine is a crystalline solid with a molecular weight of approximately 246.15 g/mol. It has a moderate solubility in organic solvents such as DMSO and poor solubility in water. Reactivity is moderate, with potential for substitution reactions. The compound exhibits good stability under normal conditions but can be susceptible to hydrolysis in strong acids or bases.

How is 7-Iodo[1,2,4]triazolo[4,3-a]pyridine (CAS: 864866-44-4) typically synthesized?

7-Iodo[1,2,4]triazolo[4,3-a]pyridine is typically synthesized via the iodination of 1,2,4-triazolo[4,3-a]pyridine using N-iodosuccinimide (NIS) as the iodinating agent. The reaction is performed in the presence of a base such as sodium hydride. The method provides a good yield and high selectivity for the iodinated product.

What industries use 7-Iodo[1,2,4]triazolo[4,3-a]pyridine (CAS: 864866-44-4)?

7-Iodo[1,2,4]triazolo[4,3-a]pyridine is used in the pharmaceutical industry for drug synthesis due to its biological activity. It is also utilized in the polymer industry for developing functional materials and in sensor applications for its unique chemical properties.

What precautions should be taken when handling 7-Iodo[1,2,4]triazolo[4,3-a]pyridine (CAS: 864866-44-4)?

When handling 7-Iodo[1,2,4]triazolo[4,3-a]pyridine, ensure proper personal protective equipment (PPE) including lab coat, gloves, and safety goggles. Store the compound in a dry, cool place, away from moisture and heat sources. Use appropriate ventilation when handling, and keep the container tightly closed. In case of spills, follow standard safety procedures and consult the Safety Data Sheet (SDS) for specific instructions.