Benzo[b]thiophen-2-ylmethanamine hydrochloride

Base Information

• Chemical Name: Benzo[b]thiophen-2-ylmethanamine hydrochloride
• CAS No.: 247570-04-3
• Molecular Formula: C₉H₉NS*ClH
• Molecular Weight: 199.704
• Hs Code.: 2934999090
• European Community (EC) Number: 840-671-4
• Mol file: 247570-04-3.mol

Synonyms:247570-04-3;Benzo[b]thiophen-2-ylmethanamine hydrochloride;(1-benzothien-2-ylmethyl)amine hydrochloride;C-Benzo[B]Thiophen-2-Yl-Methylamine Hydrochloride;Benzo[b]thiophene-2-methanamine, hydrochloride (1:1);1-benzothiophen-2-ylmethanamine;hydrochloride;Benzo[b]thiophen-2-ylmethyl-ammonium chloride;(1-benzothiophen-2-yl)methanamine hydrochloride;BENZO[B]THIOPHENE-2-METHANAMINE HYDROCHLORIDE;Arg(NO2)-OBzl.TosOH;SCHEMBL6941951;XJA57004;(1-Benzothien-2-ylmethyl)amine HCl;MFCD03306018;AKOS000492259;MCULE-9675561563;SB36164;BS-35864;DB-067260;Benzo[b]thiophen-2-ylmethanaminehydrochloride;VU0510705-1;EN300-222584;A877805;Benzo[b]thiophene-2-methanamine,hydrochloride (1:1);Z57206121;F3145-1887

Chemical Property of Benzo[b]thiophen-2-ylmethanamine hydrochloride

Chemical Property:

• PSA: 54.26000
• LogP: 3.86230
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 199.0222482
• Heavy Atom Count: 12
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

(1-benzothien-2-ylmethyl)aminehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(S2)CN.Cl

Technology Process of Benzo[b]thiophen-2-ylmethanamine hydrochloride

There total 3 articles about Benzo[b]thiophen-2-ylmethanamine hydrochloride 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: 88.0%

benzo[b]thiophene-2-carboxamide (6314-42-7) → benzo[b]thiophen-2-ylmethanamine hydrochloride (247570-04-3)

Guidance literature:

benzo[b]thiophene-2-carboxamide; With triethyl borane; phenylsilane; potassium acetate; In tetrahydrofuran; tert-butyl methyl ether; at 120 ℃; Inert atmosphere; Schlenk technique; Sealed tube;

With hydrogenchloride; In ethyl acetate; at 20 ℃; for 8h; chemoselective reaction; Inert atmosphere;

DOI:10.1021/acs.joc.9b00277

Reference yield: 88.0%

→ benzo[b]thiophen-2-ylmethanamine hydrochloride (247570-04-3)

Guidance literature:

With triethyl borane; phenylsilane; potassium acetate; In tetrahydrofuran; tert-butyl methyl ether; at 80 ℃; for 24h; Sealed tube;

With hydrogenchloride; In tetrahydrofuran; tert-butyl methyl ether; ethyl acetate; at 20 ℃; for 8h;

Reference yield:

2-cyanobenzothiophene (55219-11-9) → benzo[b]thiophen-2-ylmethanamine hydrochloride (247570-04-3) + 3-ethoxy-4-methoxybenzylamine (108439-67-4)

Guidance literature:

upstream raw materials:

2-cyanobenzothiophene

benzo[b]thiophene-2-carboxamide

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