N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride

Base Information

• Chemical Name: N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride
• CAS No.: 35517-11-4
• Molecular Formula: C₁₅H₂₀N₂O₂S*ClH
• Molecular Weight: 328.863
• DSSTox Substance ID: DTXSID20557228
• Mol file: 35517-11-4.mol

Synonyms:35517-11-4;N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride;N-(5-Aminopentyl)-1-naphthalenesulfonamide HCl;N-(5-aminopentyl)naphthalene-1-sulfonamide hydrochloride;N-(5-aminopentyl)naphthalene-1-sulfonamide;hydrochloride;SCHEMBL11629031;DTXSID20557228;N-(5-aminopentyl)naphthalene-1-sulfonamidehydrochloride;N-(5-Aminopentyl)naphthalene-1-sulfonamide--hydrogen chloride (1/1)

Chemical Property of N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride

Chemical Property:

• Appearance/Colour: White Crystalline Solid
• Vapor Pressure: 1.63E-09mmHg at 25°C
• Melting Point: 217-218°C
• Boiling Point: 483.8 °C at 760 mmHg
• Flash Point: 246.4 °C
• PSA: 80.57000
• LogP: 5.22110
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 328.1012268
• Heavy Atom Count: 21
• Complexity: 378

Purity/Quality:

98%Min ^*data from raw suppliers

N-(5-Aminopentyl)-1-naphthalenesulfonamideHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)NCCCCCN.Cl

Technology Process of N-(5-Aminopentyl)-1-naphthalenesulfonamide Hydrochloride

There total 3 articles about N-(5-Aminopentyl)-1-naphthalenesulfonamide 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: 76.0%

6-(Naphthalene-1-sulfonylamino)-hexanoic acid amide (119516-42-6) → Naphthalene-1-sulfonic acid (5-amino-pentyl)-amide; hydrochloride (35517-11-4)

Guidance literature:

With hydrogenchloride; bis-[(trifluoroacetoxy)iodo]benzene; 1.) MeCN-H₂O, RT, 6 h, 2.) H₂O;

Reference yield:

1-Naphthalenesulfonyl chloride (85-46-1) → Naphthalene-1-sulfonic acid (5-amino-pentyl)-amide; hydrochloride (35517-11-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 90 percent / 1M NaOH / tetrahydrofuran / 2 h

2: 60 percent / urea / 4 h / 180 - 200 °C

3: 76 percent / 1.) phenyliodosyl bis(trifluoroacetate), 2.) HCl conc. / 1.) MeCN-H₂O, RT, 6 h, 2.) H₂O

With hydrogenchloride; sodium hydroxide; urea; bis-[(trifluoroacetoxy)iodo]benzene; In tetrahydrofuran;

Reference yield:

6-(1-naphthalenesulfonylamino)caproic acid (78521-42-3) → Naphthalene-1-sulfonic acid (5-amino-pentyl)-amide; hydrochloride (35517-11-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 60 percent / urea / 4 h / 180 - 200 °C

2: 76 percent / 1.) phenyliodosyl bis(trifluoroacetate), 2.) HCl conc. / 1.) MeCN-H₂O, RT, 6 h, 2.) H₂O

With hydrogenchloride; urea; bis-[(trifluoroacetoxy)iodo]benzene;

upstream raw materials:

6-(Naphthalene-1-sulfonylamino)-hexanoic acid amide

1-Naphthalenesulfonyl chloride

6-(1-naphthalenesulfonylamino)caproic acid

Refernces