structure of 3,4-Dibromo-6-fluoroiodobenzene

3,4-Dibromo-6-fluoroiodobenzene

CAS No.: 1000578-17-5
M. Wt: 379.791
M. Fa: C6H2Br2FI
InChI Key: YHBXOGPDCQLVRG-UHFFFAOYSA-N

Names and Identifiers of 3,4-Dibromo-6-fluoroiodobenzene

CAS Number

1000578-17-5

MDL Number

MFCD09878132

IUPAC Name

1,2-dibromo-4-fluoro-5-iodobenzene

InChI

InChI=1S/C6H2Br2FI/c7-3-1-5(9)6(10)2-4(3)8/h1-2H

InChIKey

YHBXOGPDCQLVRG-UHFFFAOYSA-N

Canonical SMILES

FC1=CC(Br)=C(Br)C=C1I

UNSPSC Code

12352100

Physical and chemical properties of 3,4-Dibromo-6-fluoroiodobenzene

Boiling Point

298.2±40.0 °C at 760 mmHg

Density

2.6±0.1 g/cm3

Exact Mass

377.755188

Flash Point

134.1±27.3 °C

Index of Refraction

1.658

LogP

4.49

Molecular Formula

C6H2Br2FI

Molecular Weight

379.791

Vapour Pressure

0.0±0.6 mmHg at 25°C

Safety Information of 3,4-Dibromo-6-fluoroiodobenzene

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 3,4-Dibromo-6-fluoroiodobenzene

1,2-Dibromo-4-fluoro-5-iodobenzene finds applications in various domains:

  • Organic Synthesis: It serves as an important building block for synthesizing more complex organic molecules including pharmaceuticals and agrochemicals.
  • Material Science: The compound can be used in the development of specialty polymers and materials that require specific properties imparted by halogenation.
  • Research: It is utilized in chemical research for studying reaction mechanisms involving halogenated compounds.

Interaction Studies of 3,4-Dibromo-6-fluoroiodobenzene

Interaction studies involving 1,2-dibromo-4-fluoro-5-iodobenzene focus on its reactivity with various nucleophiles and electrophiles. These studies help elucidate the mechanistic pathways of substitution and coupling reactions. Understanding these interactions is crucial for optimizing synthetic routes and improving yields in industrial applications.