N-Ethylidyneethanaminium tetrafluoroborate

Base Information

• Chemical Name: N-Ethylidyneethanaminium tetrafluoroborate
• CAS No.: 462-35-1
• Molecular Formula: C4H8N.BF4
• Molecular Weight: 156.919
• DSSTox Substance ID: DTXSID10511213
• Mol file: 462-35-1.mol

Synonyms:462-35-1;N-Ethylidyneethanaminium tetrafluoroborate;DTXSID10511213

Chemical Property of N-Ethylidyneethanaminium tetrafluoroborate

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 157.0685921
• Heavy Atom Count: 10
• Complexity: 81.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [B-](F)(F)(F)F.CC[N+]#CC

Technology Process of N-Ethylidyneethanaminium tetrafluoroborate

There total 2 articles about N-Ethylidyneethanaminium tetrafluoroborate 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: 42.0%

O,O,O-triethyl phosphorothioate (126-68-1) + acetonitrile (75-05-8,26809-02-9) → triethyl phosphate (78-40-0) + O,O,S-triethyl phosphorothioate (1186-09-0) + bis(diethylphosphoryl)disulfide (4403-51-4) + N-(ethyl)acetonitrilium tetrafluoroborate (462-35-1)

Guidance literature:

With nitrosonium tetrafluoroborate; In water; Further byproducts given. Yields of byproduct given; 15-30 min;

DOI:10.1021/jo00156a006

Reference yield:

O,O,O-triethyl phosphorothioate (126-68-1) + acetonitrile (75-05-8,26809-02-9) → triethyl phosphate (78-40-0) + O,O,S-triethyl phosphorothioate (1186-09-0) + ethanol (64-17-5) + bis(diethylphosphoryl)disulfide (4403-51-4) + N-(ethyl)acetonitrilium tetrafluoroborate (462-35-1)

Guidance literature:

With nitrosonium tetrafluoroborate; for 0.5h;

DOI:10.1021/jo00156a006

Reference yield: 14.0%

N-(ethyl)acetonitrilium tetrafluoroborate (462-35-1) + methyl (triphenylphosphoranylidene)acetate (21204-67-1,2605-67-6) → methyl(triphenylphosphoranylidene)acetate tetrafluoroborate + triphenyl-1-(carbomethoxy-2-ethylaminoprop-1-enyl)phosphonium tetrafluoroboride

Guidance literature:

In dichloromethane;

DOI:10.1007/BF01142813

upstream raw materials:

O,O,O-triethyl phosphorothioate

acetonitrile

Downstream raw materials:

4-fluoro-N,N-dimethylaniline

N,N-dimethyl-aniline

4-(N-ethylacetamido)-NN-dimethylaniline

2-(N-ethylacetamido)-NN-dimethylaniline

Refernces