5-Bromo-1,2-diethoxy-3-fluorobenzene | CAS No. 876861-32-4

5-Bromo-1,2-diethoxy-3-fluorobenzene

Basic Information

CAS Number

876861-32-4

Molecular Formula

C10H12BrFO2

Molecular Weight

263.11 g/mol

AD

Basic Physical Properties

CCOc1cc(cc(c1OCC)F)Br

InChI

InChI=1S/C10H12BrFO2/c1-3-13-9-6-7(11)5-8(12)10(9)14-4-2/h5-6H,3-4H2,1-2H3

InChIKey

NMJIYYPJJHRNMJ-UHFFFAOYSA-N

LogP

3.385600000000003

Topological Polar Surface Area

18.46 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Synonyms & References

English

  • 1-bromo-2-methoxy-3-nitrobenzene

MDL Number

MFCD19441230

FAQ

What are the physical and chemical properties of 5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4)?

5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4) is a crystalline solid with a molecular weight of approximately 276.22 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and dichloromethane. Chemically, it is prone to nucleophilic substitution reactions due to the presence of the bromo and fluoro substituents.

How is 5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4) typically synthesized?

5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4) is commonly synthesized through a multi-step process involving bromination and alkylation of the parent compound. The synthesis typically requires the use of a phase transfer catalyst such as tetrabutylammonium bromide and proceeds with high selectivity and yield under mild conditions.

What industries use 5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4)?

5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4) is primarily used in pharmaceutical research and development for the synthesis of intermediates and active pharmaceutical ingredients. It has potential applications in the polymer industry for the development of functional materials and in the semiconductor industry for the production of electronic components.

What precautions should be taken when handling 5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4)?

When handling 5-Bromo-1,2-diethoxy-3-fluorobenzene (CAS: 876861-32-4), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be contained and cleaned up using appropriate safety measures as outlined in the Safety Data Sheet (SDS).

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