4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE

Base Information

• Chemical Name: 4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE
• CAS No.: 4973-73-3
• Molecular Formula: C10H8N2
• Molecular Weight: 156.187
• Mol file: 4973-73-3.mol

Synonyms:4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE

Chemical Property of 4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE

Chemical Property:

• PSA: 0.00000
• LogP: 0.98660

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE

There total 3 articles about 4-(ISOCYANOMETHYL)BENZYL-ISOCYANIDE which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 33.0%

chloroform (67-66-3,8013-54-5) + p-xylylidenediamine (539-48-0) → 1,4-bis(isocyanomethyl)benzene (4973-73-3)

Guidance literature:

With N-benzyl-N,N,N-triethylammonium chloride; In dichloromethane; water; at 40 ℃;

DOI:10.1021/jacs.8b02886

Reference yield:

p-Xylylen-diformamid (112343-44-9) → 1,4-bis(isocyanomethyl)benzene (4973-73-3)

Guidance literature:

With triethylamine; trichlorophosphate; In dichloromethane; at -60 - 20 ℃;

DOI:10.1021/ja060720r

Reference yield:

p-xylylidenediamine (539-48-0) → 1,4-bis(isocyanomethyl)benzene (4973-73-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 20 °C / Heating

2: 6.1 g / POCl₃; NEt₃ / CH₂Cl₂ / -60 - 20 °C

With triethylamine; trichlorophosphate; In dichloromethane;

DOI:10.1021/ja060720r

upstream raw materials:

p-Xylylen-diformamid

p-xylylidenediamine

chloroform

Downstream raw materials:

C₄₀H₅₈N₁₀O₁₀

Refernces

• 1、 Ali, Ameena M.,Atmaj, Jack,D?mling, Alexander,Groves, Matthew,Holak, Tad A.,Labuzek, Beata,Neochoritis, Constantinos G.,Plewka, Jacek,Ricardo, Manuel G.,Rivera, Daniel G.,Skalniak, Lukasz,Surmiak, Ewa,Zhang, Ran. "Multicomponent Peptide Stapling as a Diversity-Driven Tool for the Development of Inhibitors of Protein–Protein Interactions". supporting information. p. 5235 - 5241. Retrieved 2020/02/15.