methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride

Base Information

• Chemical Name: methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride
• CAS No.: 90942-47-5
• Molecular Formula: C9H11Cl2NO2
• Molecular Weight: 236.098
• Hs Code.: 2922499990
• Mol file: 90942-47-5.mol

Synonyms:methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride;5-AMinoMethyl-2-chloro-benzoic acid Methyl ester hydrochloride

Chemical Property of methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride

Chemical Property:

• Melting Point: 217-220 °C
• PSA: 52.32000
• LogP: 3.08760
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

methyl5-(aminomethyl)-2-chlorobenzoatehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride

There total 5 articles about methyl 5-(aminomethyl)-2-chlorobenzoate 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:

methyl 5-(((tert-butoxycarbonyl)amino)methyl)-2-chlorobenzoate (1427158-17-5) → methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride (90942-47-5)

Guidance literature:

With dihydrogen peroxide; In water; ethyl acetate; at 22 - 26 ℃; for 2h;

Reference yield:

ortho-chlorobenzoic acid (118-91-2) → methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride (90942-47-5)

Guidance literature:

Multi-step reaction with 4 steps

1.1: sulfuric acid / 16 h / 22 - 26 °C

2.1: hydrogenchloride / water; 1,4-dioxane / 12 h / Reflux

2.2: 16 h / 0 - 26 °C

3.1: potassium carbonate / N,N-dimethyl-formamide / 18 h / 22 - 26 °C

4.1: hydrogenchloride / ethyl acetate / 2 h / 22 - 26 °C

With hydrogenchloride; sulfuric acid; potassium carbonate; In 1,4-dioxane; water; ethyl acetate; N,N-dimethyl-formamide;

Reference yield:

2-chloro-5-((2,2,2-trifluoroacetamido)methyl)benzoic acid (1294496-57-3) → methyl 5-(aminomethyl)-2-chlorobenzoate hydrochloride (90942-47-5)

Guidance literature:

Multi-step reaction with 3 steps

1.1: hydrogenchloride / water; 1,4-dioxane / 12 h / Reflux

1.2: 16 h / 0 - 26 °C

2.1: potassium carbonate / N,N-dimethyl-formamide / 18 h / 22 - 26 °C

3.1: hydrogenchloride / ethyl acetate / 2 h / 22 - 26 °C

With hydrogenchloride; potassium carbonate; In 1,4-dioxane; water; ethyl acetate; N,N-dimethyl-formamide;

upstream raw materials:

5-{[(tert-butoxycarbonyl)amino]methyl}-2-chlorobenzoic acid

2-chloro-5-((2,2,2-trifluoroacetamido)methyl)benzoic acid

ortho-chlorobenzoic acid

5-(aminomethyl)-2-chloro-benzoic acid

Downstream raw materials:

2-chloro-5-((1-methylcyclopropanecarboxamido)methyl)-N-(3-((4-(trifluoromethyl)phenyl)amino)isothiazolo[4,5-b]pyridin-7-yl)benzamide

2-chloro-5-((1-methylcyclopropanecarboxamido)methyl)benzoic acid

methyl 2-chloro-5-((1-methylcyclopropanecarboxamido)methyl)benzoate

methyl 2-chloro-5-(isobutyramidomethyl)benzoate

Refernces

• 1、 -. "PHTALAZINONE DERIVATIVES AS MPEGS -1 INHIBITORS". . . Retrieved 2013/06/05.
• 2、 -. "SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS AS mPGES-1 INHIBITORS". . . Retrieved 2013/03/28.