Methyl 2-(4-aminophenyl)acetate

Base Information

• Chemical Name: Methyl 2-(4-aminophenyl)acetate
• CAS No.: 39552-81-3
• Molecular Formula: C9H11NO2
• Molecular Weight: 165.192
• Hs Code.: 2922499990
• European Community (EC) Number: 674-362-9
• Nikkaji Number: J514.132J
• Mol file: 39552-81-3.mol

Synonyms:methyl 2-(4-aminophenyl)acetate;39552-81-3;Methyl-(4-aminophenyl)acetate;methyl 4-aminophenylacetate;methyl p-aminophenylacetate;methyl (4-aminophenyl)acetate;Benzeneacetic acid, 4-amino-, methyl ester;p-(Methoxycarbonylmethyl)aniline;MFCD06200783;Methyl 4-aminobenzeneacetate;Methyl 4-aminophenylacetate;Methyl p-aminobenzeneacetate;Methyl p-aminophenylacetate;4-Aminobenzeneacetic acid methyl ester;methyl-p-aminophenylacetate;methyl-4-aminophenylacetate;methyl p-aminophenyl acetate;methyl 4-aminophenyla-cetate;Methyl(4-aminophenyl)acetate;p-methoxycarbonylmethylaniline;methyl2-(4-aminophenyl)acetate;SCHEMBL1161121;AMY14443;4-aminophenyl acetic acid methylester;AB7450;4-aminophenylacetic acid, methyl ester;AKOS000111662;PS-3073;SB74536;(4-aminophenyl)acetic acid methyl ester;4-amino-phenyl acetic acid methyl ester;4-aminobenzeneacetic acid, methyl ester;SY100571;(4-Amino-phenyl)-acetic acid methyl ester;Methyl (4-aminophenyl)acetate, AldrichCPR;CS-0028736;FT-0677341;EN300-55739;A824616;F0001-1112

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

Chemical Property:

• Melting Point: 197-200°C
• Boiling Point: 277.2 °C at 760 mmHg
• PKA: 4.36±0.10(Predicted)
• Flash Point: 136.9 °C
• PSA: 52.32000
• Density: 1.143 g/cm³
• LogP: 1.56550
• Storage Temp.: Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 165.078978594
• Heavy Atom Count: 12
• Complexity: 151

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl2-(4-Aminophenyl)acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 43-52
• Safety Statements: 36-37

MSDS Files:

Useful:

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

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

There total 13 articles about Methyl 2-(4-aminophenyl)acetate 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: 99.0%

methyl (4-nitrophenyl)acetate (2945-08-6) → methyl p-aminophenylacetate (39552-81-3)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In tetrahydrofuran; methanol; at 20 ℃; for 20h;

DOI:10.1016/j.bmc.2010.09.001

Reference yield: 99.0%

methanol (67-56-1) + 4-aminophenylacetic acid (1197-55-3) → methyl p-aminophenylacetate (39552-81-3)

Guidance literature:

With thionyl chloride; at 60 ℃; for 6h;

Reference yield: 74.0%

4-aminophenylacetic acid (1197-55-3) → methyl p-aminophenylacetate (39552-81-3)

Guidance literature:

With HCl conc.; sodium hydrogencarbonate; In methanol; hexane; ethyl acetate;

upstream raw materials:

methanol

p-aminophenylacetonitrile

4-aminophenylacetic acid

methyl (4-nitrophenyl)acetate

Downstream raw materials:

Methyl 4-[N-(4-nitrobenzyloxycarbonyl)amino]phenylacetate

[4-(2-iodo-benzoylamino)-phenyl]-acetic acid methyl ester

[4-(2-propyl-pentanoylamino)-phenyl]-acetic acid methyl ester

(ClCH₂)2NC₆H₄CH₂CO₂CH₃

Refernces

• 1、 Roberts et al.. "". . p. 4917,4923. Retrieved 1967.
• 2、 -. "HETEROCYCLIC COMPOUNDS AS INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR". Page/Page column 130. . Retrieved 2020/09/03.
• 3、 -. "Synthetic method of poly-substituted dimethyl amino phenyl acetic acid compound". Paragraph 0046-0049. . Retrieved 2021/03/05.