N-(cyclohexylmethyl)acetamide

Base Information

• Chemical Name: N-(cyclohexylmethyl)acetamide
• CAS No.: 51870-99-6
• Molecular Formula: C9H17NO
• Molecular Weight: 155.24
• NSC Number: 172994
• DSSTox Substance ID: DTXSID30305974
• Wikidata: Q82052823
• Mol file: 51870-99-6.mol

Synonyms:N-(cyclohexylmethyl)acetamide;51870-99-6;NSC172994;SCHEMBL1434420;DTXSID30305974;AKOS008933259;NSC-172994

Chemical Property of N-(cyclohexylmethyl)acetamide

Chemical Property:

• Vapor Pressure: 0.000913mmHg at 25°C
• Boiling Point: 303.7°Cat760mmHg
• Flash Point: 176.6°C
• Density: 0.932g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 155.131014166
• Heavy Atom Count: 11
• Complexity: 128

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)NCC1CCCCC1

Technology Process of N-(cyclohexylmethyl)acetamide

There total 10 articles about N-(cyclohexylmethyl)acetamide 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: 98.0%

acetyl chloride (75-36-5) + cyclohexylmethylamine (3218-02-8) → N-cyclohexylmethyl-acetamide (51870-99-6)

Guidance literature:

With pyridine; at 0 - 20 ℃; for 7h;

Reference yield: 93.0%

N-(phenylmethyl)acetamide (588-46-5) → N-cyclohexylmethyl-acetamide (51870-99-6)

Guidance literature:

With hydrogen; In water; at 100 ℃; for 3h; under 15001.5 Torr; chemoselective reaction;

DOI:10.1039/c6cy00899b

Reference yield: 15.0%

cyclohexylallene (5664-17-5) → C9H15N3 + (1-azidoallyl)cyclohexane (1542395-36-7) + N-cyclohexylmethyl-acetamide (51870-99-6)

Guidance literature:

With (triphenyl phosphite)gold(I) chloride; trimethylsilylazide; silver trifluoromethanesulfonate; trifluoroacetic acid; In dichloromethane; water; at 0 - 20 ℃; Reagent/catalyst; Temperature; Time; Schlenk technique; Inert atmosphere;

DOI:10.1039/c3cc48017h

upstream raw materials:

acetyl chloride

cyclohexylmethylamine

acetic anhydride

N-benzoyl-N-acetylbenzylamine

Downstream raw materials:

C₉H₁₆N₂O₂

N-(cyclohexylmethyl)-N-ethylamine

Refernces

• 1、 Morioka, Yuna,Matsuoka, Aki,Binder, Kellie,Knappett, Benjamin R.,Wheatley, Andrew E.H.,Naka, Hiroshi. "Selective hydrogenation of arenes to cyclohexanes in water catalyzed by chitin-supported ruthenium nanoparticles". . p. 5801 - 5805. Retrieved 2016/08/06.
• 2、 Stein, Mario,Breit, Bernhard. "Catalytic hydrogenation of amides to amines under mild conditions". supporting information. p. 2231 - 2234. Retrieved 2013/03/28.