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Thiocyanic acid, 2,6-dimethylphenyl ester, also known as 2,6-dimethylphenyl thiocyanate, is an organic compound with the chemical formula C9H11NS. It is a colorless to pale yellow liquid that is soluble in organic solvents and has a molecular weight of 163.26 g/mol. Thiocyanic acid, 2,6-dimethylphenyl ester is derived from thiocyanic acid, where the hydrogen atom is replaced by a 2,6-dimethylphenyl group, which consists of a benzene ring with two methyl groups attached at the 2nd and 6th carbon positions. Thiocyanic acid, 2,6-dimethylphenyl ester, is primarily used as an intermediate in the synthesis of various organic compounds, particularly in the production of agrochemicals and pharmaceuticals. It is also employed as a reagent in analytical chemistry for the detection of certain metal ions. Due to its potential toxicity and reactivity, it is essential to handle Thiocyanic acid, 2,6-dimethylphenyl ester with care and in accordance with proper safety protocols.

4235-83-0

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4235-83-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4235-83-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,2,3 and 5 respectively; the second part has 2 digits, 8 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 4235-83:
(6*4)+(5*2)+(4*3)+(3*5)+(2*8)+(1*3)=80
80 % 10 = 0
So 4235-83-0 is a valid CAS Registry Number.

4235-83-0Downstream Products

4235-83-0Relevant academic research and scientific papers

An electrochemical method for deborylative seleno/thiocyanation of arylboronic acids under catalyst- And oxidant-free conditions

He, Dongdong,Yao, Jiaojiao,Ma, Boling,Wei, Jinghao,Hao, Guangguo,Tuo, Xun,Guo, Shengmei,Fu, Zhengjiang,Cai, Hu

supporting information, p. 1559 - 1564 (2020/03/26)

An electrochemical deborylative seleno/thiocyanation of arylboronic acids has been well established to synthesize the corresponding aryl seleno/thiocyanates with good functional group tolerance under ambient conditions. A gram-scale reaction has been performed to highlight the advantages of the protocol. Preliminary mechanistic studies indicate that the oxidation of the seleno/thiocyanate anion occurs prior to that of the arylboronic acid substrate in galvanostatic mode, and that free radicals are involved in the process.

N -Thiocyanato-dibenzenesulfonimide: A new electrophilic thiocyanating reagent with enhanced reactivity

Li, Chengqiu,Long, Pingliang,Wu, Haopeng,Yin, Hongquan,Chen, Fu-Xue

supporting information, p. 7131 - 7134 (2019/08/07)

A novel electrophilic thiocyanating reagent, N-thiocyanato-dibenzenesulfonimide, was prepared and exhibited enhanced electrophilicity with a wide scope of substrates. Thus, it reacted with activated aromatics such as phenols, indoles, anilines and anisoles without a catalyst giving the corresponding thicyanate derivatives in high yields, while TfOH for unactivated arenes and hetero aromatics and Zn(OTf)2 for ketones was used as the catalyst, respectively. It is noteworthy that internal alkenes and styrenes were bifunctionalized giving 1,2-amino thiocyanates in high yields.

Electrochemical ipso-Thiocyanation of Arylboron Compounds

Dyga, Marco,Hayrapetyan, Davit,Rit, Raja K.,Goo?en, Lukas J.

supporting information, p. 3548 - 3553 (2019/04/26)

An operationally simple electrochemical method for the transition-metal-free ipso-thiocyanation of arylboronic acids and aryl trifluoroborates has been developed. The SCN electrophile is generated in situ by anodic oxidation of thiocyanate anions, which avoids formation of salt waste and prevents unwanted side reactions arising from chemical oxidants. The reaction proceeds regiospecifically, and the scope extends to non-activated aromatic systems. (Figure presented.).

Improved procedure to aryl thiocyanates: A new synthetic application of dry arenediazonium o-benzenedisulfonimides

Barbero,Degani,Diulgheroff,Dughera,Fochi

, p. 585 - 590 (2007/10/03)

Aryl thiocyanates 3 (22 examples) were easily prepared by reaction of dry arenediazonium o-benzenedisulfonimides 1 and sodium thiocyanate (2) in anhydrous acetonitrile at room temperature (20-25 °C) in the presence of copper powder (Procedure A) and at 50 °C or room temperature without the metal catalyst (Procedure B). The yields were from very good to excellent in Procedure A (average yield = 83%), and from modest to excellent in Procedure B (average yield = 63%). In comparison with the thiocyanod-ediazoniation carried out under traditional Sandmeyer-type conditions, the yields of 3 were higher and the isothiocyanate isomers were formed only in traces. Moreover, the results obtained in the absence of copper confirm the role of the anion of salts 1 as an electron transfer agent.

Syntheses of Organic N,N-Dialkyldithiocarbamates or Organic Thiocyanates from Organozincs and Corresponding Thio-Anions via the Inversion of Electronic Reactivity of the Anions with NCS-Oxidation

Takagi, Kentaro,Takachi, Hideaki,Sasaki, Ken

, p. 6552 - 6556 (2007/10/03)

Novel displacement of metal ions from organometallic compounds with nucleophilic reagents was achieved in the reaction between organozinc compounds and N,N-dialkyldithiocarbamate ions (N,N-DAD-) or thiocyanate ion by the assistance of NCS, whereby alkyl or aryl N,N-DAD or alkyl, alkenyl, alkynyl, aryl, or heteroaryl thiocyanates were obtained in moderate to excellent yields as the result of novel bond construction between carbon fragments from organozinc compounds and thio-anions.

Facile Synthesis of Organic Thiocyanates from Organozinc(II) Thiocyanates and N-chlorosuccinimide

Takagi, Kentaro,Takachi, Hideaki,Hayama, Naomi

, p. 509 - 510 (2007/10/02)

The reaction of organozinc(II) compounds, generated in situ from organolithiums and zinc(II) thiocyaniate, with N-chlorosuccinimide (NCS) afforded the corresponding organic thiocyanates in good yields.

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