N-benzyl-1-cyclohexylmethanamine

Base Information

• Chemical Name: N-benzyl-1-cyclohexylmethanamine
• CAS No.: 4352-47-0
• Molecular Formula: C14H21 N
• Molecular Weight: 203.327
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID80361161
• Nikkaji Number: J734.200D
• Wikidata: Q82143342
• Mol file: 4352-47-0.mol

Synonyms:N-benzyl-1-cyclohexylmethanamine;4352-47-0;N-(CYCLOHEXYLMETHYL)BENZYLAMINE;N-(cyclohexylmethyl)-1-phenyl-methanamine;benzyl(cyclohexylmethyl)amine;(Cyclohexylmethyl)benzylamine;Oprea1_091504;SCHEMBL7603669;DTXSID80361161;N-benzyl-N-(cyclohexylmethyl)amine;BBL023395;MFCD01016938;STK120212;AKOS000226365;N-(cyclohexylmethyl)-1-phenylmethanamine;CS-0270027;EN300-932983;AN-329/34876009

Chemical Property of N-benzyl-1-cyclohexylmethanamine

Chemical Property:

• Vapor Pressure: 0.00108mmHg at 25°C
• Boiling Point: 301°C at 760 mmHg
• Flash Point: 134.1°C
• PSA: 12.03000
• Density: 0.952g/cm³
• LogP: 3.74740
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 203.167399674
• Heavy Atom Count: 15
• Complexity: 155

Purity/Quality:

98%Min ^*data from raw suppliers

N-benzyl-1-cyclohexylmethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)CNCC2=CC=CC=C2

Technology Process of N-benzyl-1-cyclohexylmethanamine

There total 20 articles about N-benzyl-1-cyclohexylmethanamine 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%

benzylamine (100-46-9) + cyclohexanecarbaldehyde (2043-61-0) → N-(cyclohexylmethyl)(phenyl)methanamine (4352-47-0)

Guidance literature:

With acetic acid; 1-hydrosilatrane; at 20 ℃; for 1h; Green chemistry;

DOI:10.1002/adsc.201700079

Reference yield: 94.0%

Ν-(cyclohexylmethyl)benzamide (46721-86-2) → N-(cyclohexylmethyl)(phenyl)methanamine (4352-47-0)

Guidance literature:

Ν-(cyclohexylmethyl)benzamide; With 2-fluoropyridine; trifluoromethylsulfonic anhydride; In dichloromethane; at 0 ℃; for 0.333333h;

With 1,1,3,3-Tetramethyldisiloxane; In dichloromethane; at 0 - 20 ℃; for 3.16667h;

With tris(pentafluorophenyl)borate; In dichloromethane; at 0 - 20 ℃;

DOI:10.1021/acs.joc.6b00572

Reference yield: 92.0%

carbon monoxide (201230-82-2) + benzylamine (100-46-9) + cyclohexene (110-83-8) → N-(cyclohexylmethyl)(phenyl)methanamine (4352-47-0)

Guidance literature:

With Ru_nano/TiO₂; hydrogen; In tetrahydrofuran; at 160 ℃; for 12h; Green chemistry;

DOI:10.1039/d1gc00113b

upstream raw materials:

benzaldehyde

cyclohexylmethylamine

benzylamine

cyclohexanecarbaldehyde

Downstream raw materials:

benzyl-cyclohexylmethyl-(2-piperidino-ethyl)-amine

Refernces

• 1、 Fan, Qing-Hua,Liu, Xintong,Luo, Zhenli,Pan, Yixiao,Xu, Lijin,Yang, Ji,Yao, Zhen,Zhang, Xin. "BF3·Et2O as a metal-free catalyst for direct reductive amination of aldehydes with amines using formic acid as a reductant". supporting information. p. 5205 - 5211. Retrieved 2021/07/29.
• 2、 An, Jinghua,Gao, Zhuyan,Wang, Yehong,Zhang, Zhixin,Zhang, Jian,Li, Lu,Tang, Bo,Wang, Feng. "Heterogeneous Ru/TiO2for hydroaminomethylation of olefins: multicomponent synthesis of amines". supporting information. p. 2722 - 2728. Retrieved 2021/04/21.