3-Bromo-5-fluoro-2-iodotoluene
CAS No.:
1000576-60-2
M. Wt:
314.922
M. Fa:
C7H5BrFI
InChI Key:
FGWWSTPAPGETQF-UHFFFAOYSA-N
Appearance:
Solid
Names and Identifiers of 3-Bromo-5-fluoro-2-iodotoluene
CAS Number |
1000576-60-2 |
|---|---|
MDL Number |
MFCD09800772 |
IUPAC Name |
1-bromo-5-fluoro-2-iodo-3-methylbenzene |
InChI |
InChI=1S/C7H5BrFI/c1-4-2-5(9)3-6(8)7(4)10/h2-3H,1H3 |
InChIKey |
FGWWSTPAPGETQF-UHFFFAOYSA-N |
Canonical SMILES |
CC1=CC(F)=CC(Br)=C1I |
UNSPSC Code |
12352100 |
Physical and chemical properties of 3-Bromo-5-fluoro-2-iodotoluene
Boiling Point |
263.7±35.0 °C at 760 mmHg |
|---|---|
Density |
2.1±0.1 g/cm3 |
Exact Mass |
313.860321 |
Flash Point |
113.3±25.9 °C |
H Bond Acceptors |
0 |
H Bond Donors |
0 |
Index of Refraction |
1.614 |
LogP |
4.37 |
Molecular Formula |
C7H5BrFI |
Molecular Weight |
314.922 |
Vapour Pressure |
0.0±0.5 mmHg at 25°C |
Safety Information of 3-Bromo-5-fluoro-2-iodotoluene
Applications of 3-Bromo-5-fluoro-2-iodotoluene
3-Bromo-5-fluoro-2-iodotoluene has several applications:
- Organic Synthesis: It serves as a versatile intermediate for creating complex organic molecules and pharmaceuticals.
- Material Science: Utilized in the production of specialty chemicals and advanced materials.
- Research: Employed in proteomics and other biochemical studies due to its unique reactivity.
Biological Activity of 3-Bromo-5-fluoro-2-iodotoluene
While specific biological activities of 3-Bromo-5-fluoro-2-iodotoluene are not extensively documented, its role as a building block in the synthesis of biologically active molecules suggests potential applications in drug discovery. Compounds with similar structures often exhibit antimicrobial and anticancer properties, indicating that this compound may also interact with biological targets relevant in pharmacology.
Physical sample testing spectrum (NMR) of 3-Bromo-5-fluoro-2-iodotoluene
