5-Bromo-6-fluoro-1H-benzo[d]imidazole

Basic Information

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CAS Number

1008360-84-6

Molecular Formula

C7H4BrFN2

Molecular Weight

215.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=C2C(=CC(=C1F)Br)N=CN2

InChI

InChI=1S/C7H4BrFN2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-3H,(H,10,11)

InChIKey

JNOXZOAZSLHRAA-UHFFFAOYSA-N

LogP

2.4645

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

155

Synonyms & References

English

6-bromo-5-fluoro-1H-Benzimidazole
5-Bromo-6-fluoro-1H-benzo[d]imidazole
5-bromo-6-fluoro-1H-benzimidazole
ACMC-2097sp
AG-L-20062
ANW-14375
CTK3J9286
SureCN3044280
5-Bromo-6-fluorobenzoimidazole
5-Bromo-6-fluoro-1H-benzoimidazole
5-bromo-6-fluoro-1H-1,3-benzodiazole
JNOXZOAZSLHRAA-UHFFFAOYSA-N
1H-Benzimidazole, 6-bromo-5-fluoro-
RP26854
6-bromo-5-fluoro-1H-benzo[d]imidazole
Z6318
1008360-84-6
SCHEMBL14723315
MFCD11846341
SCHEMBL3044280
SY102239
5-bromo-6-fluoro-3H-1,3-benzodiazole
DB-368565
AKOS015835985
C71045
DTXSID70682059
DS-11647
J-517123
5-Bromo-6-fluoro-1H-benzimidazole

MDL Number

MFCD11846341

FAQ

What are the physical and chemical properties of 5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6)?

5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6) is a crystalline solid with a molecular weight of approximately 245.03 g/mol. It is slightly soluble in water and ethanol. Chemically, it is highly reactive towards nucleophiles and can undergo various substitution reactions. It is stable under normal conditions but should be stored in a fume hood to avoid inhalation exposure.

How is 5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6) typically synthesized?

5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6) is synthesized by the bromination and fluorination of 1H-benzo[d]imidazole or its derivatives. Common methods include using N-bromosuccinimide (NBS) and N-fluorobencenesulfonimide (NFBS) as catalysts. The yield and selectivity depend on the reaction conditions and the choice of reagents.

What industries use 5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6)?

5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6) is primarily used in pharmaceuticals for developing drugs targeting specific molecular pathways. It is also utilized in the synthesis of fluorescent dyes and sensors for detecting specific compounds. Additionally, it has applications in the semiconductor industry for creating thin-film coatings.

What precautions should be taken when handling 5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6)?

When handling 5-Bromo-6-fluoro-1H-benzo[d]imidazole (CAS: 1008360-84-6), always wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Store it in a well-ventilated area and use a fume hood during operations to prevent inhalation exposure. In case of a spill, immediately clean up with appropriate absorbent materials and dispose of according to safety guidelines. Refer to the Safety Data Sheet (SDS) for detailed safety information.