2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine

Basic Information

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CAS Number

889447-20-5

Molecular Formula

C6H3ClIN3

Molecular Weight

279.47 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=C(C2=NC(=CN=C2N1)Cl)I

InChI

InChI=1S/C6H3ClIN3/c7-4-2-10-6-5(11-4)3(8)1-9-6/h1-2H,(H,9,10)

InChIKey

JYAUQLBWOPEZFN-UHFFFAOYSA-N

LogP

2.2159000000000004

Topological Polar Surface Area

41.57 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

157

Synonyms & References

English

2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine
2-chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine
2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (ACI)
4H-Pyrrolo[2,3-b]pyrazine, 2-chloro-7-iodo- (9CI)
2-Chloro-7-iodo-4H-pyrrolo[2,3-b]pyrazine
SCHEMBL650607
AKOS024260309
JYAUQLBWOPEZFN-UHFFFAOYSA-N
DTXSID701272930
PB25471
AS-33593
DA-16948
CS-0051924
MFCD12755891
889447-20-5

MDL Number

MFCD12755891

FAQ

What are the physical and chemical properties of 2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (CAS: 889447-20-5)?

2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine is a crystalline solid with a molecular weight of approximately 336.01 g/mol. It has limited water solubility and is poorly soluble in common organic solvents. The compound is relatively stable but can react with strong nucleophiles. It may undergo substitution reactions under certain conditions.

How is 2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (CAS: 889447-20-5) typically synthesized?

2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine is typically synthesized through a multi-step process involving the protection of a pyrazine ring, subsequent introduction of chlorine and iodine functionalities, and deprotection steps. Common synthetic methods include electrophilic aromatic substitution reactions and coupling reactions under mild or moderate conditions.

What industries use 2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (CAS: 889447-20-5)?

2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine is used in the pharmaceutical industry for the development of potential drug candidates. It may also find applications in sensors and semiconductors due to its unique electronic properties.

What precautions should be taken when handling 2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine (CAS: 889447-20-5)?

Proper personal protective equipment (PPE) such as gloves, goggles, and lab coats should be worn when handling 2-Chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine. It should be handled in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate safety protocols, and the material safety data sheet (MSDS) should be consulted for detailed instructions.