CAS 50592-31-9

Benzene-1,2,4,5-d4,3-bromo-6-fluoro-

Description:

Benzene-1,2,4,5-d4,3-bromo-6-fluoro- is a halogenated aromatic compound characterized by its unique molecular structure, which includes a benzene ring substituted with both bromine and fluorine atoms, as well as deuterium isotopes at specific positions. The presence of deuterium (D) instead of hydrogen (H) enhances its stability and alters its physical properties, such as boiling and melting points, compared to its non-deuterated counterparts. The bromine and fluorine substituents contribute to the compound's reactivity, making it useful in various chemical syntheses and applications, including pharmaceuticals and agrochemicals. The compound's CAS number, 50592-31-9, allows for precise identification in chemical databases. Its unique isotopic composition can also be advantageous in studies involving nuclear magnetic resonance (NMR) spectroscopy, where deuterium provides distinct spectral features. Overall, Benzene-1,2,4,5-d4,3-bromo-6-fluoro- is a valuable compound in both research and industrial contexts due to its distinctive properties and reactivity.

Formula: C₆BrD₄F

InChI: InChI=1S/C6H4BrF/c7-5-1-3-6(8)4-2-5/h1-4H/i1D,2D,3D,4D

InChI key: AITNMTXHTIIIBB-RHQRLBAQSA-N

SMILES: [2H]C1=C(C(=C(C(=C1F)[2H])[2H])Br)[2H]

Synonyms:

• p-Bromofluorobenzene-d4

1-Bromo-4-fluorobenzene-D4

CAS: 50592-31-9

1-Bromo-4-fluorobenzene-D4

Formula: C₆D₄BrF

Purity: 98%

Molecular weight: 179.02

Ref: 54-DE2168

Benzene-1,2,4,5-D4,3-bromo-6-fluoro

CAS: 50592-31-9

Benzene-1,2,4,5-D4,3-bromo-6-fluoro is the deuterium labeled Benzenebromo-6-fluoro that can be used for isotopic tracing applications.

Formula: C₆H₄BrF

Molecular weight: 179.023

Ref: TM-TMIR-0190

4-Bromofluorobenzene-d4

CAS: 460-00-4, 50592-31-9

Formula: BrC₆D₄F

Purity: 98 atom % D

Color and Shape: Colorless Liquid

Molecular weight: 177.97315

Ref: 3U-D5577

p-Bromofluorobenzene-d4

Controlled Product

CAS: 50592-31-9

Applications p-Bromofluorobenzene-d4 is the isotope labelled analog of p-Bromofluorobenzene (B684545); a dihalogenated benzene used in the preparation of pharmaceutical compounds such as atypical antipsychotic agents.
References Sunil K.I.V. et al.: Beil. J. Org. Chem., 7, 29 (2011); Li, W. et al.: Adv. Mat. Res., 236, 2594 (2011)

Formula: C₆D₄BrF

Color and Shape: Neat

Molecular weight: 179.02

Ref: TR-B684547

4-Bromofluorobenzene-D4

Controlled Product

CAS: 50592-31-9

Please enquire for more information about 4-Bromofluorobenzene-D4 including the price, delivery time and more detailed product information at the technical inquiry form on this page

Formula: C₆D₄BrF

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 179.02 g/mol

Ref: 3D-FB77676