n-[(4-Nitrophenyl)sulfonyl]glutamic acid

Base Information

• Chemical Name: n-[(4-Nitrophenyl)sulfonyl]glutamic acid
• CAS No.: 6328-28-5
• Molecular Formula: C₁₁H₁₂N₂O₈S
• Molecular Weight: 332.291
• NSC Number: 406611,43656
• DSSTox Substance ID: DTXSID40286063
• Mol file: 6328-28-5.mol

Synonyms:6328-28-5;n-[(4-nitrophenyl)sulfonyl]glutamic acid;NSC43656;SCHEMBL7100832;DTXSID40286063;NSC-43656;NSC406611;AKOS002969945;NSC-406611

Chemical Property of n-[(4-Nitrophenyl)sulfonyl]glutamic acid

Chemical Property:

• Vapor Pressure: 1.08E-15mmHg at 25°C
• Boiling Point: 609.2°C at 760 mmHg
• Flash Point: 322.2°C
• PSA: 174.97000
• Density: 1.601g/cm³
• LogP: 2.18600
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 332.03143652
• Heavy Atom Count: 22
• Complexity: 527

Purity/Quality:

99% ^*data from raw suppliers

2-[(4-NITROPHENYL)SULFONYLAMINO]PENTANEDIOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NC(CCC(=O)O)C(=O)O

Technology Process of n-[(4-Nitrophenyl)sulfonyl]glutamic acid

There total 1 articles about n-[(4-Nitrophenyl)sulfonyl]glutamic 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:

L-glutamic acid (56-86-0,21675-62-7,23009-64-5,25104-13-6,84960-48-5,25513-46-6) + 4-Nitrobenzenesulfonyl chloride (98-74-8) → 2-N-(4'-nitrobenzenesulphonyl)-L(+)-glutamic acid (6328-28-5)

Guidance literature:

With sodium hydroxide;

Reference yield:

2-N-(4'-nitrobenzenesulphonyl)-L(+)-glutamic acid (6328-28-5) → N-sulfanilyl-L-glutamic acid (6328-29-6,6946-28-7)

Guidance literature:

With palladium; acetic acid; Hydrogenation;

Reference yield:

2-N-(4'-nitrobenzenesulphonyl)-L(+)-glutamic acid (6328-28-5) → (2S)-5-oxo-2-[(nitrobenzene-4-yl sulfonyl)amino]-5-(butylamino)pentanoic acid

Guidance literature:

Multi-step reaction with 2 steps

1: acetyl chloride / 2 h / Reflux

2: hydrogenchloride / water

With hydrogenchloride; acetyl chloride; In water;

DOI:10.1016/j.ejmech.2017.09.052

upstream raw materials:

L-glutamic acid

4-Nitrobenzenesulfonyl chloride

Downstream raw materials:

N-sulfanilyl-L-glutamic acid

(2S)-5-amino-5-oxo-2-[(nitrobenzene-4-ylsulfonyl)amino]pentanoic acid

(2S)-5-oxo-2-[(nitrobenzene-4-yl sulfonyl)amino]-5-(ethylamino)pentanoic acid