N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine

Base Information

• Chemical Name: N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine
• CAS No.: 86052-56-4
• Molecular Formula: C₁₁H₁₃NS₂
• Molecular Weight: 223.363
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID50427884
• Wikidata: Q82240615
• Mol file: 86052-56-4.mol

Synonyms:N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine;86052-56-4;2-thiophen-2-yl-N-(thiophen-2-ylmethyl)ethanamine;2-Thiopheneethanamine,N-(2-thienylmethyl)-;SCHEMBL10962630;DTXSID50427884;AKOS000125064;WAY-663350;EN300-14650;Z90577997;[2-(thiophen-2-yl)ethyl][(thiophen-2-yl)methyl]amine;[2-(THIOPHEN-2-YL)ETHYL](THIOPHEN-2-YLMETHYL)AMINE

Chemical Property of N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine

Chemical Property:

• Vapor Pressure: 0.000132mmHg at 25°C
• Boiling Point: 334°C at 760 mmHg
• Flash Point: 155.8°C
• PSA: 68.51000
• Density: 1.192g/cm3
• LogP: 3.53280
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 223.04894177
• Heavy Atom Count: 14
• Complexity: 163

Purity/Quality:

N-(2-THIEN-2-YLETHYL)-N-(THIEN-2-YLMETHYL)AMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CSC(=C1)CCNCC2=CC=CS2

Technology Process of N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine

There total 3 articles about N-(2-thien-2-ylethyl)-N-(thien-2-ylmethyl)amine 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:

1-(Thien-2-yl)-4-(thien-2-yl)-2-azabuta-1,3-diene (86052-32-6) → (2-Thiophen-2-yl-ethyl)-thiophen-2-ylmethyl-amine (86052-56-4)

Guidance literature:

With sodium tetrahydroborate; In ethanol; at 50 ℃; for 1h;

DOI:10.1055/s-1987-27902

Reference yield:

thiophene-2-carbaldehyde (98-03-3) → (2-Thiophen-2-yl-ethyl)-thiophen-2-ylmethyl-amine (86052-56-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 100 percent / ethanol / 1 h / Heating

2: 85 percent / 50percent aq. NaOH / tetra-n-butylammonium iodide / toluene / 0.5 h / 40 °C

3: sodium borohydride / ethanol / 1 h / 50 °C

With sodium hydroxide; sodium tetrahydroborate; tetra-(n-butyl)ammonium iodide; In ethanol; toluene;

DOI:10.1055/s-1987-27902

Reference yield:

Diethyl N-2-thienylideneaminomethylphosphonate (86052-31-5) → (2-Thiophen-2-yl-ethyl)-thiophen-2-ylmethyl-amine (86052-56-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 85 percent / 50percent aq. NaOH / tetra-n-butylammonium iodide / toluene / 0.5 h / 40 °C

2: sodium borohydride / ethanol / 1 h / 50 °C

With sodium hydroxide; sodium tetrahydroborate; tetra-(n-butyl)ammonium iodide; In ethanol; toluene;

DOI:10.1055/s-1987-27902

upstream raw materials:

1-(Thien-2-yl)-4-(thien-2-yl)-2-azabuta-1,3-diene

thiophene-2-carbaldehyde

Diethyl N-2-thienylideneaminomethylphosphonate

Refernces