3-Cyclohexylpropanamide

Base Information

• Chemical Name: 3-Cyclohexylpropanamide
• CAS No.: 4361-29-9
• Molecular Formula: C9H17NO
• Molecular Weight: 155.24
• DSSTox Substance ID: DTXSID70338887
• Nikkaji Number: J80.804K
• Wikidata: Q82107584
• Mol file: 4361-29-9.mol

Synonyms:3-Cyclohexylpropanamide;3-Cyclohexylpropionamide;4361-29-9;3-Cyclohexylpropanamide #;SCHEMBL885302;DTXSID70338887;STK208082;AKOS003299453;EN300-74882;Z33547070

Chemical Property of 3-Cyclohexylpropanamide

Chemical Property:

• PSA: 44.08000
• LogP: 2.98190
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 155.131014166
• Heavy Atom Count: 11
• Complexity: 128

Purity/Quality:

3-cyclohexylpropanamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)CCC(=O)N

Technology Process of 3-Cyclohexylpropanamide

There total 13 articles about 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: 100.0%

3-cyclohexyl-2-(2-pyridylsulfanyl)-propionamide (189809-76-5) → 3-cyclohexylpropanamide (4361-29-9)

Guidance literature:

With sodium tetrahydroborate; nickel dichloride; In ethanol; water; for 5h; Ambient temperature;

DOI:10.1016/S0040-4039(97)00418-8

Reference yield: 65.0%

cyclohexylmercury chloride (24371-94-6) + 2-propenamide (79-06-1,12624-24-7,25038-45-3,27754-57-0,33338-03-3,39387-77-4,68247-81-4,9082-06-8,79079-15-5) → 3-cyclohexylpropanamide (4361-29-9)

Guidance literature:

With sodium tetrahydroborate; In dichloromethane; at 0 - 5 ℃; for 0.5h;

Reference yield: 65.0%

Cyclohexylquecksilberacetat (10341-90-9) + 2-propenamide (79-06-1,12624-24-7,25038-45-3,27754-57-0,33338-03-3,39387-77-4,68247-81-4,9082-06-8,79079-15-5) → 3-cyclohexylpropanamide (4361-29-9)

Guidance literature:

With sodium tetrahydroborate; In dichloromethane; at 20 ℃; Rate constant;

upstream raw materials:

diazomethane

cyclohexylacetic acid chloride

cyclohexanepropionic acid

cyclohexylmercury chloride

Downstream raw materials:

3-cyclohexylpropan-1-amine

c-hexylethyl isocyanate