6-Chloro-4-iodonicotinonitrile

Basic Information

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CAS Number

1061357-83-2

Molecular Formula

C6H2ClIN2

Molecular Weight

253.47 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

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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Clc1cc(I)c(cn1)C#N

InChI

InChI=1S/C6H5ClIN/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3

InChIKey

ZWCNVOMJDJPZHE-UHFFFAOYSA-N

LogP

2.6480200000000007

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

164

Synonyms & References

English

6-Chloro-4-iodonicotinonitrile
2-Chloro-5-cyano-4-iodopyridine
6-Chloro-4-iodo-3-pyridinecarbonitrile
6-chloro-4-iodopyridine-3-carbonitrile
6-chloro-4-iodo-nicotinonitrile
TVHRQDVVPKXZOZ-UHFFFAOYSA-N
1396AA
PB19460
CM10370
FCH1346736
AX8163089
ST24045292

MDL Number

MFCD16658125

FAQ

What are the physical and chemical properties of 6-Chloro-4-iodonicotinonitrile (CAS: 1061357-83-2)?

6-Chloro-4-iodonicotinonitrile is a crystalline solid with a molecular weight of approximately 326.01 g/mol. It is slightly soluble in water and more soluble in organic solvents like ethanol and acetonitrile. It exhibits moderate reactivity, particularly in nucleophilic substitution reactions.

How is 6-Chloro-4-iodonicotinonitrile (CAS: 1061357-83-2) typically synthesized?

6-Chloro-4-iodonicotinonitrile can be synthesized through the nucleophilic substitution of 4-chloronicotinonitrile with iodine in the presence of a base like potassium carbonate. The reaction involves the use of a solvent such as acetonitrile and typically yields a product with high selectivity.

What industries use 6-Chloro-4-iodonicotinonitrile (CAS: 1061357-83-2)?

6-Chloro-4-iodonicotinonitrile is primarily used in the pharmaceutical industry for the synthesis of intermediates and bioactive compounds. It is also utilized in the polymer industry for the development of specific polymers and in the semiconductor industry for certain manufacturing processes.

What precautions should be taken when handling 6-Chloro-4-iodonicotinonitrile (CAS: 1061357-83-2)?

When handling 6-Chloro-4-iodonicotinonitrile, it is important to use personal protective equipment (PPE) such as gloves and safety glasses. Work should be performed in a fume hood. Spills should be cleaned up using appropriate absorbents, and the material safety data sheet (MSDS) should be consulted for detailed safety information.