2-((4-Bromobenzyl)amino)acetamide

Base Information

• Chemical Name: 2-((4-Bromobenzyl)amino)acetamide
• CAS No.: 850859-09-5
• Molecular Formula: C9H11BrN2O
• Molecular Weight: 243.103
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID30588346
• Wikidata: Q82480966
• Mol file: 850859-09-5.mol

Synonyms:2-((4-Bromobenzyl)amino)acetamide;850859-09-5;2-{[(4-bromophenyl)methyl]amino}acetamide;2-(4-bromobenzylamino)acetamide;2-[(4-bromophenyl)methylamino]acetamide;SCHEMBL840310;DTXSID30588346;NQZMMTNIHLKPIN-UHFFFAOYSA-N;AKOS000134109;MCULE-4236748525;N~2~-[(4-Bromophenyl)methyl]glycinamide;EN300-49112;Z90608485

Chemical Property of 2-((4-Bromobenzyl)amino)acetamide

Chemical Property:

• PSA: 56.11000
• LogP: 2.56460
• Storage Temp.: 2-8°C
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 242.00548
• Heavy Atom Count: 13
• Complexity: 167

Purity/Quality:

95+% ^*data from raw suppliers

2-([(4-BROMOPHENYL)METHYL]AMINO)ACETAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CNCC(=O)N)Br

Technology Process of 2-((4-Bromobenzyl)amino)acetamide

There total 2 articles about 2-((4-Bromobenzyl)amino)acetamide 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: 79.0%

glycinamide hydrochloride (1668-10-6) + 4-bromo-benzaldehyde (1122-91-4) → 2-(4-bromobenzylamino)acetamide (850859-09-5)

Guidance literature:

With sodium tetrahydroborate; sodium hydroxide; In methanol; water; at 20 ℃; for 26h;

DOI:10.1016/j.bcp.2018.03.018

Reference yield:

α-aminoacetamide hydrochloride + 4-bromo-benzaldehyde (1122-91-4) → 2-(4-bromobenzylamino)acetamide (850859-09-5)

Guidance literature:

α-aminoacetamide hydrochloride; 4-bromo-benzaldehyde; With sodium hydroxide; In methanol; water; at 20 ℃; for 17h;

With sodium tetrahydroborate; water; In methanol;

Reference yield: 48.0%

2-(4-bromobenzylamino)acetamide (850859-09-5) + 1,1'-carbonyldiimidazole (530-62-1) → 1-(4-bromobenzyl)imidazolidine-2,4-dione (201987-81-7)

Guidance literature:

With dmap; In acetonitrile; at 60 ℃; for 48h;

DOI:10.1016/j.bcp.2018.03.018

upstream raw materials:

glycinamide hydrochloride

4-bromo-benzaldehyde

Downstream raw materials:

1-(4-bromobenzyl)imidazolidine-2,4-dione

1-(4-bromobenzyl)-3-methylimidazolidine-2,4-dione

1-(4-(2-cyclopropyl-1-oxoisoindolin-5-yl)benzyl)-3-methylimidazolidine-2,4-dione

3-methyl-1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)imidazolidine-2,4-dione