N-Ethylbenzylamine

Base Information

• Chemical Name: N-Ethylbenzylamine
• CAS No.: 14321-27-8
• Molecular Formula: C9H13N
• Molecular Weight: 135.209
• Hs Code.: 29214980
• European Community (EC) Number: 238-265-1
• UNII: MM8324KE8V
• DSSTox Substance ID: DTXSID7022259
• Nikkaji Number: J270D
• Wikidata: Q23978270
• ChEMBL ID: CHEMBL1178178
• Mol file: 14321-27-8.mol

Synonyms:N-Ethylbenzylamine;N-benzylethanamine;14321-27-8;Benzenemethanamine, N-ethyl-;Ethylbenzylamine;N-Benzylethylamine;Benzyl(Ethyl)Amine;Benzylethylamine;Benzylamine, N-ethyl-;N-ethyl-N-benzylamine;N-Benzyl-N-ethylamine;ethyl-benzyl-amine;MFCD00009031;Etilefrine Impurity F;ethyl(phenylmethyl)amine;BENZYL-ETHYL-AMINE;EINECS 238-265-1;N-(phenylmethyl)ethanamine;UNII-MM8324KE8V;MM8324KE8V;N-Benzylethanamine (Benzylethylamine);Benzylamine, N-ethyl-, hydrochloride;5417-36-7;Benzenemethanamine, N-ethyl-, hydrochloride;benzyl ethylamine;n-ethylbenzylamin;N-Ethylbenzylamne;ethyl benzyl amine;n-ethyl-benzylamine;N-benzyl-ethylamine;N-ethyl benzylamine;N-ethylbenzyl amine;NEBA;N-ethyl benzyl amine;N-benzyl-N-ethyl amine;n-ethylbenzenemethanamine;N-Ethylbenzylamine, 97%;SCHEMBL2146;CHEMBL1178178;DTXSID7022259;N-(PHENYLMETHYL)ETHYLAMINE;STR05968;STK864195;N-Ethylbenzylamine Benzyl ethyl amine;AKOS000119463;CS-W013340;LS-184962;E0383;FT-0637057;EN300-18192;D77748;A808038;J-007773;J-523567;Q23978270;Z57327176;F2190-0317

Chemical Property of N-Ethylbenzylamine

Chemical Property:

• Appearance/Colour: clear colorless to slightly yellow liquid
• Vapor Pressure: 0.518mmHg at 25°C
• Melting Point: 191-194 °C
• Refractive Index: n20/D 1.511(lit.)
• Boiling Point: 191.3 °C at 760 mmHg
• PKA: 9.77±0.10(Predicted)
• Flash Point: 66.7 °C
• PSA: 12.03000
• Density: 0.916 g/cm³
• LogP: 2.18700
• Storage Temp.: Store below +30°C.
• Sensitive.: Air Sensitive
• Solubility.: slightly soluble
• Water Solubility.: slightly soluble
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 135.104799419
• Heavy Atom Count: 10
• Complexity: 74.8

Purity/Quality:

99% ^*data from raw suppliers

N-Ethylbenzylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37-52
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCNCC1=CC=CC=C1
• Uses: N-Ethylbenzylamine has been used to demonstrate the reactivity of NDTE (2,5-dihydroxyphenylacetic acid, 2,5-bis-tetrahydropyranyl ether p-nitrophenyl ester) and HLTE (homogentisic gamma-lactone tetrahydropyranyl ether). It has also been used to prepare 2-[(N-Benzyl, N-ethyl)amino]derivative using 2-chloro-4H-pyrido[1,2-a]pyrimidin-4-one.

Technology Process of N-Ethylbenzylamine

There total 88 articles about N-Ethylbenzylamine 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: 62.0%

ethyl iodide (75-03-6) + benzylamine (100-46-9) → N,N-diethylbenzylamine (772-54-3) + N-ethylbenzylamine (14321-27-8)

Guidance literature:

benzylamine; With carbon dioxide; 1-butyl-3-methylimidazolium Tetrafluoroborate; at 55 ℃; under 760 Torr; Electrochemical reaction;

ethyl iodide; at 20 ℃; for 2h;

DOI:10.1021/jo061997c

Reference yield: 57.0%

trifluoromethanesulfonic acid ethyl ester (425-75-2) + benzylamine (100-46-9) → N,N-diethylbenzylamine (772-54-3) + N-ethylbenzylamine (14321-27-8)

Guidance literature:

With 1,1,1,3',3',3'-hexafluoro-propanol; at 20 ℃; for 1h;

DOI:10.1039/c3cc48997c

Reference yield: 48.0%

acetaldehyde (75-07-0,9002-91-9) + Benzaldoxime (932-90-1) → N,N-diethylbenzylamine (772-54-3) + N-ethylbenzylamine (14321-27-8) + dibenzylamine (103-49-1)

Guidance literature:

With hydrogen; magnesium oxide; copper; at 210 ℃; under 7500.6 Torr;

DOI:10.1023/B:RUGC.0000030394.26179.a0

upstream raw materials:

N-(phenylmethyl)acetamide

N-(benzylidene)ethylamine

N-ethylidenebenzylamine

N-benzyl-N-ethyl-4-methylbenzenesulfonamide

Downstream raw materials:

N-benzyl-2-(ethylamino)ethanol

ethyl-benzyl-(2-[4]pyridyl-ethyl)-amine

N-ethyl-N-methylbenzylamine

dichloro-acetic acid-(ethyl-benzyl-amide)

Refernces

• 1、 Grassie,Purves. "-". . p. 677,679. Retrieved 1948.
• 2、 Banks, Ronald E.,Barrage, Abdul-Karim,Khoshdel, Ezzatollah. "Conversion of Alcohols into Monofluorides: Development of Polymeric Analogue (PFAR) of the Yarovenko-Raksha Fluoroalkylamine Reagent (FAR), Et2NCF2CHFCl". . p. 93 - 98. Retrieved 1981.
• 3、 Qiu, Ruomeng,Yu, Mingcheng,Gong, Juwen,Tian, Jinlong,Huang, Yafei,Wang, Yonghui,Xie, Qiong. "Discovery of tert-amine-based RORγt agonists". . . Retrieved 2021/07/26.
• 4、 Han, Bo,Jiao, Haijun,Wu, Lipeng,Zhang, Jiong. "Zirconium-hydride-catalyzed site-selective hydroboration of amides for the synthesis of amines: Mechanism, scope, and application". . p. 2059 - 2067. Retrieved 2021/09/02.