N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide

Base Information

• Chemical Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide
• CAS No.: 6357-83-1
• Molecular Formula: C₁₇H₁₅NO₄S
• Molecular Weight: 329.376
• Hs Code.: 2922199090
• DSSTox Substance ID: DTXSID30979790
• Mol file: 6357-83-1.mol

Synonyms:N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide;6357-83-1;DTXSID30979790;AKOS003889705;N-(3-Cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanimidic acid

Chemical Property of N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide

Chemical Property:

• Vapor Pressure: 6.55E-12mmHg at 25°C
• Boiling Point: 544.4°C at 760 mmHg
• Flash Point: 283°C
• PSA: 95.01000
• Density: 1.15g/cm³
• LogP: 4.99790
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 330.17658463
• Heavy Atom Count: 23
• Complexity: 465

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3CCCCC3

Technology Process of N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide

There total 1 articles about N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclohexylpropanamide 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:

8-amino-1-naphthol-5-sulfonic acid (83-64-7) + p-toluidine (106-49-0,12221-03-3) → 5-hydroxy-4-p-toluidino-naphthalene-1-sulfonic acid (6357-83-1)

Guidance literature:

With p-toluidine hydrochloride; water; at 120 ℃; unter Druck;

upstream raw materials:

8-amino-1-naphthol-5-sulfonic acid

p-toluidine