8-Bromo-3-chloro-5-isopropylisoquinoline | CAS No. 2660255-85-4

8-Bromo-3-chloro-5-isopropylisoquinoline

Basic Information

CAS Number

2660255-85-4

Molecular Formula

C12H11BrClN

Molecular Weight

284.58 g/mol

AD

Basic Physical Properties

CC(C)c1ccc(Br)c2cnc(Cl)cc12

InChI

InChI=1S/C12H11BrClN/c1-7(2)8-3-4-11(13)10-6-15-12(14)5-9(8)10/h3-7H,1-2H3

InChIKey

GUZXCNBBJSVUBW-UHFFFAOYSA-N

LogP

4.7741000000000025

Topological Polar Surface Area

12.89 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Synonyms & References

English

  • Isoquinoline, 8-bromo-3-chloro-5-(1-methylethyl)-
  • 8-Bromo-3-chloro-5-isopropylisoquinoline

FAQ

What are the physical and chemical properties of 8-Bromo-3-chloro-5-isopropylisoquinoline (CAS: 2660255-85-4)?

8-Bromo-3-chloro-5-isopropylisoquinoline is a solid with a crystalline form. Its molecular weight is approximately 297.01 g/mol. This compound is slightly soluble in water but more soluble in organic solvents like ethanol and acetone. Chemically, it is reactive towards nucleophiles and can undergo substitution reactions. It is not flammable but can react with strong oxidizers.

How is 8-Bromo-3-chloro-5-isopropylisoquinoline (CAS: 2660255-85-4) typically synthesized?

8-Bromo-3-chloro-5-isopropylisoquinoline is synthesized by bromination of 3-chloro-5-isopropylisoquinoline followed by bromination. The reaction is catalyzed by a Lewis acid such as aluminum bromide. The yield is typically around 70-80%, with high selectivity for the bromine substitution. The reaction is carried out under anhydrous conditions to avoid side reactions.

What industries use 8-Bromo-3-chloro-5-isopropylisoquinoline (CAS: 2660255-85-4)?

8-Bromo-3-chloro-5-isopropylisoquinoline is used in the pharmaceutical industry for the synthesis of various compounds. It is also explored in the chemical sensor industry for its ability to detect specific gases. Additionally, it has applications in the semiconductor industry for certain chemical processes.

What precautions should be taken when handling 8-Bromo-3-chloro-5-isopropylisoquinoline (CAS: 2660255-85-4)?

When handling 8-Bromo-3-chloro-5-isopropylisoquinoline, it is crucial to use personal protective equipment such as gloves and safety goggles. Work should be conducted in a well-ventilated fume hood to avoid inhalation. In case of spill, the area should be cleaned with water and appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.

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