N-(3-nitrobenzyl)ethanamine hydrochloride

Base Information

• Chemical Name: N-(3-nitrobenzyl)ethanamine hydrochloride
• CAS No.: 90389-71-2
• Molecular Formula: C9H12N2O2
• Molecular Weight: 216.667
• ChEMBL ID: CHEMBL13654
• Mol file: 90389-71-2.mol

Synonyms:N-(3-nitrobenzyl)ethanamine hydrochloride;90389-71-2;Ethyl-(3-nitro-benzyl)-amine HCl;N-[(3-nitrophenyl)methyl]ethanamine;hydrochloride;Ethyl-(3-nitro-benzyl)-aMine HYDROCHLORIDE Salt;CHEMBL13654;SCHEMBL952234;CS-D0538;MFCD07110182;AKOS030524947;SB79267;N-(3-nitrobenzyl)ethanaminehydrochloride;AS-40801;EN300-36753;Ethyl-(3-nitro-benzyl)-aMine HYDROCHLORIDE;ethyl[(3-nitrophenyl)methyl]amine hydrochloride;Z381061424

Chemical Property of N-(3-nitrobenzyl)ethanamine hydrochloride

Chemical Property:

• PSA: 57.85000
• LogP: 2.61840
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 216.0665554
• Heavy Atom Count: 14
• Complexity: 168

Purity/Quality:

99% ^*data from raw suppliers

Ethyl-(3-nitro-benzyl)amineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNCC1=CC(=CC=C1)[N+](=O)[O-].Cl

Technology Process of N-(3-nitrobenzyl)ethanamine hydrochloride

There total 1 articles about N-(3-nitrobenzyl)ethanamine 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:

N-acetyl-3-nitrobenzylamine (180080-55-1) → N-(3-Nitrobenzyl)ethaneamine hydrochloride (90389-71-2)

Guidance literature:

N-acetyl-3-nitrobenzylamine; With borane-THF; In tetrahydrofuran; at 40 ℃;

With hydrogenchloride; In tetrahydrofuran; water; at 60 ℃; for 4h;

Reference yield:

N-(3-Nitrobenzyl)ethaneamine hydrochloride (90389-71-2) → (3-Aminobenzyl)ethylamine

Guidance literature:

With iron; acetic acid; at 110 ℃; for 0.5h;

upstream raw materials:

N-acetyl-3-nitrobenzylamine

Refernces

• 1、 -. "Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors". Page/Page column 26. . Retrieved 2008/06/13.