p-Sulfanilylbenzylamine

Base Information

• Chemical Name: p-Sulfanilylbenzylamine
• CAS No.: 4393-19-5
• Molecular Formula: C13H14N2O2S
• Molecular Weight: 262.32700
• Hs Code.: 2921590090
• UNII: OWT4VJ75LS
• DSSTox Substance ID: DTXSID30594381
• Nikkaji Number: J8.716E
• Wikidata: Q27285889
• Mol file: 4393-19-5.mol

Synonyms:Alphamide;p-sulfanilylbenzylamine;4393-19-5;p-Aminomethylphenyl sulfone;p-Sulfanilylbenzylamine [MI];UNII-OWT4VJ75LS;OWT4VJ75LS;Benzenemethanamine, 4-((4-aminophenyl)sulfonyl)-;benzenemethanamine,4-[(4-aminophenyl)sulfonyl]-;SCHEMBL151654;DTXSID30594381;PD160394;4-[4-(Aminomethyl)benzene-1-sulfonyl]aniline;Q27285889

Chemical Property of p-Sulfanilylbenzylamine

Chemical Property:

• Vapor Pressure: 4.28E-10mmHg at 25°C
• Melting Point: 159°
• Boiling Point: 499.1oC at 760 mmHg
• Flash Point: 255.6oC
• PSA: 94.56000
• Density: 1.311g/cm3
• LogP: 3.92260
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 262.07759887
• Heavy Atom Count: 18
• Complexity: 348

Purity/Quality:

95% ^*data from raw suppliers

PARA-SULFANILYLBENZYLAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CN)S(=O)(=O)C2=CC=C(C=C2)N

Technology Process of p-Sulfanilylbenzylamine

There total 5 articles about p-Sulfanilylbenzylamine 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:

4-(4-nitro-benzenesulfonyl)-benzylamine (4393-17-3) → p-sulfanilylbenzylamine (4393-19-5)

Guidance literature:

With hydrogenchloride; palladium on activated charcoal; Hydrogenation;

DOI:10.1039/jr9460000466

Reference yield:

4-nitrophenyl 4-toluenesulfonate (4094-37-5) → p-sulfanilylbenzylamine (4393-19-5)

Guidance literature:

Multi-step reaction with 3 steps

1: dibenzoyl peroxide; nitrobenzene; bromine / 160 °C

3: Raney nickel; H₂O / 40 °C / 20594.2 Torr / Hydrogenation

With water; bromine; nickel; nitrobenzene; dibenzoyl peroxide;

DOI:10.1021/jo01362a050

Reference yield:

(4-bromomethyl-phenyl)-(4-nitro-phenyl)-sulfone (100398-04-7) → p-sulfanilylbenzylamine (4393-19-5)

Guidance literature:

Multi-step reaction with 2 steps

2: Raney nickel; H₂O / 40 °C / 20594.2 Torr / Hydrogenation

With water; nickel;

DOI:10.1021/jo01362a050

upstream raw materials:

4-(4-nitro-benzenesulfonyl)-benzylamine

4-nitrophenyl 4-toluenesulfonate

4-(acetylamino-methyl)-benzenesulfinic acid

4-(acetamidomethyl)benzene-1-sulfonyl chloride