2-Amino-5-(2,4-dinitroanilino)pentanoic acid;hydrochloride

Base Information

• Chemical Name: 2-Amino-5-(2,4-dinitroanilino)pentanoic acid;hydrochloride
• CAS No.: 64821-45-0
• Molecular Formula: C₁₁H₁₄N₄O₆*ClH
• Molecular Weight: 334.716
• Hs Code.: 2922499990
• DSSTox Substance ID: DTXSID60585121
• Mol file: 64821-45-0.mol

Synonyms:64821-45-0;2-Amino-5-(2,4-dinitroanilino)pentanoic acid;hydrochloride;DTXSID60585121;Ndelta-DNP-L-ornithine hydrochloride;N delta -DNP-L-ornithine hydrochloride;Ndelta-(2,4-Dinitrophenyl)-L-ornithine hydrochloride;N~5~-(2,4-Dinitrophenyl)ornithine--hydrogen chloride (1/1)

Chemical Property of 2-Amino-5-(2,4-dinitroanilino)pentanoic acid;hydrochloride

Chemical Property:

• Vapor Pressure: 1.88E-14mmHg at 25°C
• Boiling Point: 583.4°C at 760 mmHg
• Flash Point: 306.6°C
• PSA: 166.99000
• LogP: 3.72870
• Storage Temp.: −20°C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 334.0680119
• Heavy Atom Count: 22
• Complexity: 393

Purity/Quality:

98% ^*data from raw suppliers

N-DELTA-(2,4-DINITROPHENYL)-L-ORNITHINE HYDROCHLORIDE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Amino-5-(2,4-dinitroanilino)pentanoic acid;hydrochloride

There total 3 articles about 2-Amino-5-(2,4-dinitroanilino)pentanoic acid;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:

2,4-Dinitrofluorobenzene (70-34-8,65727-75-5) → Nδ-(2.4-dinitro-phenyl)-L-ornithine ; hydrochloride (64821-45-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 1 M aq. NaOH / ethanol / 24 h / Heating

2: aq. HCl, AcOH / 1 h

With hydrogenchloride; sodium hydroxide; acetic acid; In ethanol;

DOI:10.1021/jm980073h

Reference yield:

N2-(tert-butoxycarbonyl)-L-ornithine (21887-64-9) → Nδ-(2.4-dinitro-phenyl)-L-ornithine ; hydrochloride (64821-45-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 1 M aq. NaOH / ethanol / 24 h / Heating

2: aq. HCl, AcOH / 1 h

With hydrogenchloride; sodium hydroxide; acetic acid; In ethanol;

DOI:10.1021/jm980073h

Reference yield:

Nδ-DNP-Nα-t-butoxycarbonyl-L-ornithine (82518-61-4) → Nδ-(2.4-dinitro-phenyl)-L-ornithine ; hydrochloride (64821-45-0)

Guidance literature:

With hydrogenchloride; acetic acid; for 1h; Yield given;

DOI:10.1021/jm980073h

upstream raw materials:

N^δ-DNP-N^α-t-butoxycarbonyl-L-ornithine

2,4-Dinitrofluorobenzene

N₂-(tert-butoxycarbonyl)-L-ornithine

Refernces