N,N-dibutylcyclohexanamine

Base Information

• Chemical Name: N,N-dibutylcyclohexanamine
• CAS No.: 4230-04-0
• Molecular Formula: C14H29 N
• Molecular Weight: 211.391
• Hs Code.: 2921300090
• DSSTox Substance ID: DTXSID001311127
• Nikkaji Number: J164.809H
• ChEMBL ID: CHEMBL324442
• Mol file: 4230-04-0.mol

Synonyms:N,N-dibutylcyclohexanamine;Dibutyl-cyclohexyl-amine;4230-04-0;N,N-DIBUTYLCYCLOHEXANAMINE HYDROCHLORIDE;Cyclohexyldibutylamine;SCHEMBL627799;CHEMBL324442;DTXSID001311127;AKOS015906262

Chemical Property of N,N-dibutylcyclohexanamine

Chemical Property:

• PSA: 3.24000
• LogP: 5.02330
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 211.229999929
• Heavy Atom Count: 15
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

N,N-DIBUTYLCYCLOHEXANAMINE HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCN(CCCC)C1CCCCC1

Technology Process of N,N-dibutylcyclohexanamine

There total 8 articles about N,N-dibutylcyclohexanamine 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: 90.0%

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) + dibutylamine (111-92-2) → N,N-dibutylcyclohexylamine (4230-04-0)

Guidance literature:

With palladium on activated charcoal; hydrogen; In water; at 100 ℃; for 15h; under 7500.75 Torr;

DOI:10.1039/c8gc01686k

Reference yield: 80.0%

n-propylmagnesium bromide (927-77-5) + cyclohexyl-3 perhydrodioxazepine-1,5,3 (75872-62-7) → N,N-dibutylcyclohexylamine (4230-04-0)

Guidance literature:

DOI:10.1016/S0040-4039(00)81719-0

Reference yield: 76.0%

1-bromo-butane (109-65-9) + cyclohexylammonium bromide (26227-54-3) → N-butylcyclohexylamine (10108-56-2) + N,N-dibutylcyclohexylamine (4230-04-0)

Guidance literature:

With triethylamine; In N,N-dimethyl-formamide; at 20 - 25 ℃; for 16h; chemoselective reaction; Molecular sieve;

DOI:10.1039/c4ra01915f

upstream raw materials:

tributyl-amine

cyclohexanol

phenol

cyclohexanone

Downstream raw materials:

Dibutyl-carbamic acid 2,2,2-trichloro-ethyl ester

cyclohexene

Refernces

• 1、 Bragoni, Valentina,Rit, Raja K.,Kirchmann, Robin,Trita, A. Stefania,Goo?en, Lukas J.. "Synthesis of bio-based surfactants from cashew nutshell liquid in water". . p. 3210 - 3213. Retrieved 2018/07/29.
• 2、 Kozlov,Basalaeva. "Synthesis of N,N-dialkylcyclohexyl(methylcyclohexyl)amines". . p. 632 - 636. Retrieved 2007/10/03.