Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-

Base Information

• Chemical Name: Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-
• CAS No.: 211513-22-3
• Molecular Formula: C₁₈H₂₇NOS
• Molecular Weight: 305.484
• DSSTox Substance ID: DTXSID20432026
• Mol file: 211513-22-3.mol

Synonyms:211513-22-3;Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-;SCHEMBL1524009;DTXSID20432026

Chemical Property of Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-

Chemical Property:

• XLogP3: 5.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 305.18133566
• Heavy Atom Count: 21
• Complexity: 336

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2S

Technology Process of Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-

There total 2 articles about Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)- 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:

1-(3-methyl-butyl)-cyclohexanecarbothioic acid S-(2-{[1-(3-methyl-butyl)-cyclohexanecarbonyl]-amino}-phenyl) ester (211514-48-6) → N-(2-mercaptophenyl)-1-isopentylcyclohexanecarboxamide (211513-22-3)

Guidance literature:

With potassium hydroxide; In tetrahydrofuran; methanol;

DOI:10.1016/j.bmcl.2004.02.071

Reference yield:

2-amino-benzenethiol (137-07-5) → N-(2-mercaptophenyl)-1-isopentylcyclohexanecarboxamide (211513-22-3)

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine / CHCl₃

2: aq. KOH / tetrahydrofuran; methanol

With pyridine; potassium hydroxide; In tetrahydrofuran; methanol; chloroform;

DOI:10.1016/j.bmcl.2004.02.071

Reference yield:

Tetrahydrofurfuryl chloride (3003-84-7) + ethanol (6 ml)-water + N-(2-mercaptophenyl)-1-isopentylcyclohexanecarboxamide (211513-22-3) → 2-tetrahydrofurylmethyl2-(1-isopentylcyclohexanecarbonylamino)phenyl disulfide

Guidance literature:

With sodium thiosulfate;

upstream raw materials:

1-(3-methyl-butyl)-cyclohexanecarbothioic acid S-(2-{[1-(3-methyl-butyl)-cyclohexanecarbonyl]-amino}-phenyl) ester

2-amino-benzenethiol

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 211513-22-3 Cyclohexanecarboxamide, N-(2-mercaptophenyl)-1-(3-methylbutyl)-

Send

Send

Metric Ton KG G Pound L ML

Send

Send