Methyl 2-(4-aminophenyl)acetate hydrochloride

Base Information

• Chemical Name: Methyl 2-(4-aminophenyl)acetate hydrochloride
• CAS No.: 83528-16-9
• Molecular Formula: C9H11 N O2 . Cl H
• Molecular Weight: 201.653
• Hs Code.: 2922498590
• European Community (EC) Number: 675-993-2
• DSSTox Substance ID: DTXSID80512939
• Mol file: 83528-16-9.mol

Synonyms:83528-16-9;methyl 2-(4-aminophenyl)acetate hydrochloride;(4-Amino-phenyl)-acetic acid methyl ester HCl;4-amino-benzeneacetic acid methyl ester hcl;methyl 2-(4-aminophenyl)acetate;hydrochloride;Methyl2-(4-aminophenyl)acetatehydrochloride;methyl 4-aminophenylacetate hydrochloride;SCHEMBL6801556;(4-amino-phenyl)-acetic acid methyl ester hydrochloride;DTXSID80512939;WRZBLDDHUMBLKP-UHFFFAOYSA-N;MFCD06796526;AKOS015995790;SB77847;AS-35409;CS-0172520;EN300-28630;A13982;(4-amino-phenyl)-aceticacidmethylesterhydrochloride;Methyl (4-aminophenyl)acetate--hydrogen chloride (1/1);Z285139238

Chemical Property of Methyl 2-(4-aminophenyl)acetate hydrochloride

Chemical Property:

• Vapor Pressure: 0.00042mmHg at 25°C
• Boiling Point: 311.3°C at 760 mmHg
• Flash Point: 142.1°C
• PSA: 52.32000
• LogP: 2.36750
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 201.0556563
• Heavy Atom Count: 13
• Complexity: 151

Purity/Quality:

97% ^*data from raw suppliers

(4-Aminophenyl)aceticAcidMethylEsterHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CC1=CC=C(C=C1)N.Cl

Technology Process of Methyl 2-(4-aminophenyl)acetate hydrochloride

There total 4 articles about Methyl 2-(4-aminophenyl)acetate 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: 100.0%

methanol (67-56-1) + 4-aminophenylacetic acid (1197-55-3) → methyl 2-(4-aminophenyl)acetate hydrochloride (83528-16-9)

Guidance literature:

With thionyl chloride; at 0 - 20 ℃; for 15.5h; Reflux;

DOI:10.1039/c8md00578h

Reference yield: 86.0%

methyl (4-nitrophenyl)acetate (2945-08-6) → methyl 2-(4-aminophenyl)acetate hydrochloride (83528-16-9)

Guidance literature:

methyl (4-nitrophenyl)acetate; With water; tin(ll) chloride; In ethyl acetate; for 48h; Reflux;

With hydrogenchloride; In diethyl ether; at 4 ℃;

DOI:10.1021/jm4005972

Reference yield:

4-aminophenylacetic acid (1197-55-3) → methyl 2-(4-aminophenyl)acetate hydrochloride (83528-16-9)

Guidance literature:

With thionyl chloride; In methanol;

upstream raw materials:

methanol

4-aminophenylacetic acid

tert-butyl methyl ether

methyl (4-nitrophenyl)acetate

Downstream raw materials:

methyl 2-(4-((tert-butoxycarbonyl)amino)phenyl)acetate

methyl 2-(4-(2-chloroacetamido)phenyl)acetate