Tert-butyl 2-cyanoacrylate

Base Information

• Chemical Name: Tert-butyl 2-cyanoacrylate
• CAS No.: 37891-36-4
• Molecular Formula: C8H11NO2
• Molecular Weight: 153.181
• DSSTox Substance ID: DTXSID00565341
• Nikkaji Number: J539.081H
• Wikidata: Q82450391
• Mol file: 37891-36-4.mol

Synonyms:tert-butyl 2-cyanoacrylate;37891-36-4;tert-Butyl 2-cyanoprop-2-enoate;t-butyl 2-cyanoacrylate;t-Butyl alpha-cyanoacrylate;SCHEMBL451457;DTXSID00565341

Chemical Property of Tert-butyl 2-cyanoacrylate

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 153.078978594
• Heavy Atom Count: 11
• Complexity: 226

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)C(=C)C#N

Technology Process of Tert-butyl 2-cyanoacrylate

There total 1 articles about Tert-butyl 2-cyanoacrylate 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:

2-cyanoacrylic acid (15802-18-3) + tert-butyl alcohol (75-65-0) → tert-butyl 2-cyanoacrylate (37891-36-4)

Guidance literature:

With phosphorus pentachloride; hydroquinone; Yield given. Multistep reaction; 1.) o-xylene, toluene, 2.) toluene, 15 min;

DOI:10.1007/BF00698262

upstream raw materials:

2-cyanoacrylic acid

tert-butyl alcohol

Refernces