Benzylamine, N-ethyl-N-nitroso-

Base Information

• Chemical Name: Benzylamine, N-ethyl-N-nitroso-
• CAS No.: 20689-96-7
• Molecular Formula: C9H12N2O
• Molecular Weight: 164.207
• European Community (EC) Number: 870-716-3
• DSSTox Substance ID: DTXSID30174748
• Nikkaji Number: J36.100C
• Wikidata: Q83044865
• ChEMBL ID: CHEMBL165256
• Mol file: 20689-96-7.mol

Synonyms:20689-96-7;N-benzyl-N-ethylnitrous amide;BENZYLAMINE, N-ETHYL-N-NITROSO-;N-nitroso-n-ethyl-benzylamine;N-Nitroso-N-ethylbenzylamin;N-Ethyl-N-nitrosobenzylamine;N-Nitroso-N-ethylbenzylamine;BENZYL(ETHYL)NITROSOAMINE;N-Nitroso-N-ethylbenzylamin [German];BRN 2641123;Ethylbenzylnitrosamine;CHEMBL165256;SCHEMBL8845671;1-benzyl-1-ethyl-2-oxohydrazine;DTXSID30174748;FEMRUGMGKZBXOL-UHFFFAOYSA-N;Benzenemethanamine, N-ethyl-N-nitroso;AKOS006279320;Benzenemethanamine, N-ethyl-N-nitroso-;LS-43366;EN300-1296530;Z1198158367

Chemical Property of Benzylamine, N-ethyl-N-nitroso-

Chemical Property:

• Vapor Pressure: 0.0011mmHg at 25°C
• Refractive Index: 1.5373 (estimate)
• Boiling Point: 310.5°Cat760mmHg
• Flash Point: 141.6°C
• Density: 1.02g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 164.094963011
• Heavy Atom Count: 12
• Complexity: 133

Purity/Quality:

99% ^*data from raw suppliers

N-NITROSO-N-ETHYL-BENZYLAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC1=CC=CC=C1)N=O

Technology Process of Benzylamine, N-ethyl-N-nitroso-

There total 7 articles about Benzylamine, N-ethyl-N-nitroso- 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: 93.0%

N-ethylbenzylamine (14321-27-8) → N-benzyl-N-ethylnitrous amide (20689-96-7)

Guidance literature:

With sodium nitrite; In dichloromethane; at 20 ℃; for 0.0833333h;

DOI:10.1002/jccs.201300136

Reference yield:

N,N-diethylbenzylamine (772-54-3) + acetic acid (64-19-7,77671-22-8) → N-benzyl-N-ethylnitrous amide (20689-96-7) + benzaldehyde (100-52-7) + benzoic acid (65-85-0,8013-63-6)

Guidance literature:

Reference yield:

→ N-benzyl-N-ethylnitrous amide (20689-96-7)

Guidance literature:

With sodium nitrite;

upstream raw materials:

tetranitromethane

N,N-dibenzylethanamine

N,N-diethylbenzylamine

N-ethylbenzylamine

Refernces

• 1、 Chen, Zuxing,Gao, Meng,Lu, Cuifen,Ma, Chao,Ruan, Mengyao,Wang, Feiyi,Wang, Ying,Yang, Guichun,You, Shiqi. "The Use of Potassium/Sodium Nitrite as a Nitrosating Agent in the Electrooxidative N-Nitrosation of Secondary Amines". supporting information. p. 3289 - 3293. Retrieved 2021/07/02.
• 2、 Ghorbani-Vaghei, Ramin,Shiri, Lotfi,Ghorbani-Choghamarani, Arash. "Facile N-nitrosation of secondary amines using poly(N,N'-dibromo-Nethylene- benzene-1,3-disulfonamide) and N,N,N′,N′-tetrabromobenzene-1,3- disulfonamide/NaNO2 under mild conditions". . p. 204 - 208. Retrieved 2013/07/26.