I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid

Base Information

Chemical Name:I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid
CAS No.:868635-08-9
Molecular Formula:C₉H₁₀N₂O₄
Molecular Weight:210.189
Hs Code.:
DSSTox Substance ID:DTXSID701268151

Synonyms:SCHEMBL1648359;DTXSID701268151;868635-08-9;I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid

Suppliers and Price of I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid

Chemical Property:

XLogP3:-1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:210.06405680
Heavy Atom Count:15
Complexity:268

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C1=CC=C(C=C1)[N+](=O)[O-])(C(=O)O)N

Technology Process of I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid

There total 2 articles about I+/--Amino-I+/--methyl-4-nitrobenzeneacetic acid 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: 15.0%

: 64464-22-8
(R,S)-5-methyl-5-(4-nitro-phenyl)-imidazolidine-2,4-dione

: 868635-08-9
2-(4-nitrophenyl)-2-methylglycine

Guidance literature:: With hydrogenchloride; In water; at 130 ℃; for 67h;
DOI:10.1016/j.bmc.2005.05.019

Reference yield:

: 100-19-6
(4-nitrophenyl)ethanone

: 868635-08-9
2-(4-nitrophenyl)-2-methylglycine

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / ethanol; H₂O / 5 h / 45 °C / sonication

2: 15 percent / HCl / H₂O / 67 h / 130 °C

With hydrogenchloride; In ethanol; water; 1: Bucherer-Bergs reaction;
DOI:10.1016/j.bmc.2005.05.019

Reference yield:

: 868635-08-9
2-(4-nitrophenyl)-2-methylglycine

: 100-19-6
(4-nitrophenyl)ethanone

Guidance literature:: With ethylenediaminetetraacetic acid; potassium chloride; 5-ethylsulfanylmethyl-3-hydroxy-2-methylpyridine-4-carbaldehyde; HEPES buffer; In water; acetonitrile; at 60 ℃; pH=7.0; Further Variations:; Solvents; Reagents; Temperatures; Kinetics;
DOI:10.1016/j.bmc.2005.05.019