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5-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile is a complex organic chemical compound with the molecular formula C14H18BN3O4. It is a derivative of benzonitrile, featuring a nitro group at the 5-position and a 1,3,2-dioxaborolane group at the 2-position. The 1,3,2-dioxaborolane group is a boron-containing moiety that is often used in Suzuki-Miyaura cross-coupling reactions, a type of carbon-carbon bond-forming reaction in organic synthesis. 5-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile is a valuable intermediate in the synthesis of various pharmaceuticals and other organic compounds due to its ability to participate in palladium-catalyzed coupling reactions, which are crucial for constructing complex molecular structures.

1565857-68-2

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1565857-68-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 1565857-68-2 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,5,6,5,8,5 and 7 respectively; the second part has 2 digits, 6 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 1565857-68:
(9*1)+(8*5)+(7*6)+(6*5)+(5*8)+(4*5)+(3*7)+(2*6)+(1*8)=222
222 % 10 = 2
So 1565857-68-2 is a valid CAS Registry Number.

1565857-68-2Relevant academic research and scientific papers

Fast and Tight Boronate Formation for Click Bioorthogonal Conjugation

Akgun, Burcin,Hall, Dennis G.

, p. 3909 - 3913 (2016/03/19)

A new click bioorthogonal reaction system was devised to enable the fast ligation (kON≈340 m-1 s-1) of conjugatable derivatives of a rigid cyclic diol (nopoldiol) and a carefully optimized boronic acid partner, 2-methyl-5-carboxymethylphenylboronic acid. Using NMR and fluorescence spectroscopy studies, the corresponding boronates were found to form reversibly within minutes at low micromolar concentration in water, providing submicromolar equilibrium constant (Keq≈105-106 m-1). Efficient protein conjugation under physiological conditions was demonstrated with model proteins thioredoxin and albumin, and characterized by mass spectrometry and gel electrophoresis.

Synthesis of trimethylstannyl arylboronate compounds by sandmeyer-type transformations and their applications in chemoselective cross-coupling reactions

Qiu, Di,Wang, Shuai,Tang, Shengbo,Meng, He,Jin, Liang,Mo, Fanyang,Zhang, Yan,Wang, Jianbo

, p. 1979 - 1988 (2014/04/03)

A synthetic method based on Sandmeyer-type reactions to access both tin- and boron-substituted arenes from nitroaniline derivatives is described. This transformation can be applied to the synthesis of a series of functionalized trimethylstannyl arylboronates. In addition, the chemoselective reaction of the Stille and Suzuki-Miyaura cross-coupling reactions is explored, and a series of m- and p-terphenyl derivatives have been synthesized by conducting consecutive one-pot Stille and Suzuki-Miyaura cross-coupling reactions.

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