CAS 1420880-42-7

4′-(Bromomethyl)[1,1′-biphenyl-2′,3′,5′,6′-d4]-2-carbonitrile

Description:

4′-(Bromomethyl)[1,1′-biphenyl-2′,3′,5′,6′-d4]-2-carbonitrile is a chemical compound characterized by its biphenyl structure, which consists of two phenyl rings connected by a single bond. The presence of a bromomethyl group indicates that a bromomethyl substituent is attached to one of the phenyl rings, enhancing its reactivity and potential applications in organic synthesis. The designation "d4" signifies that the compound contains deuterium, a stable isotope of hydrogen, which can be useful in studies involving isotopic labeling or tracing. The carbonitrile functional group (-C≡N) contributes to the compound's polarity and can participate in various chemical reactions, such as nucleophilic additions. This compound may be utilized in research and development, particularly in the fields of medicinal chemistry and materials science, due to its unique structural features and potential for further functionalization. As with many brominated compounds, it is important to handle it with care, considering the environmental and health implications associated with bromine-containing substances.

Formula: C₁₄H₁₀BrN

InChI: InChI=1S/C14H10BrN/c15-9-11-5-7-12(8-6-11)14-4-2-1-3-13(14)10-16/h1-8H,9H2/i5D,6D,7D,8D

InChI key: InChIKey=LFFIEVAMVPCZNA-KDWZCNHSSA-N

SMILES: C(#N)C1=C(C=CC=C1)C2=C(C(=C(CBr)C(=C2[2H])[2H])[2H])[2H]

Synonyms:

• 2-[4-(Bromomethyl)-2,3,5,6-tetradeuteriophenyl]benzonitrile
• [1,1′-Biphenyl-2′,3′,5′,6′-d4]-2-carbonitrile, 4′-(bromomethyl)-
• 4′-(Bromomethyl)[1,1′-biphenyl-2′,3′,5′,6′-d4]-2-carbonitrile
• 4a€-Bromomethyl-2-cyanobiphenyl-d4

4’-Bromomethyl-2-cyanobiphenyl-d4

Controlled Product

CAS: 1420880-42-7

Formula: C₁₄D₄H₆BrN

Color and Shape: Neat

Molecular weight: 276.165

Ref: TR-B685337