N-(2-Aminoethyl)-N-ethyl-m-toluidine

Base Information

• Chemical Name: N-(2-Aminoethyl)-N-ethyl-m-toluidine
• CAS No.: 19248-13-6
• Molecular Formula: C11H18 N2
• Molecular Weight: 178.277
• Hs Code.: 2921590090
• European Community (EC) Number: 242-914-4
• NSC Number: 151043
• UNII: VQZ989I52Z
• DSSTox Substance ID: DTXSID5027803
• Nikkaji Number: J37.742B
• Wikidata: Q27291975
• ChEMBL ID: CHEMBL3183251
• Mol file: 19248-13-6.mol

Synonyms:N-(2-Aminoethyl)-N-ethyl-m-toluidine;19248-13-6;N-(2-aminoethyl)-N-ethyl-N-(3-methylphenyl)amine;Ethylenediamine, N-ethyl-N-m-tolyl-;1,2-Ethanediamine, N1-ethyl-N1-(3-methylphenyl)-;1,2-Ethanediamine, N-ethyl-N-(3-methylphenyl)-;N-ethyl-N-(3-methylphenyl)ethane-1,2-diamine;N-Ethyl-N-(beta-aminoethyl)-m-toluidine;N-Ethyl-N-(m-tolyl)ethylenediamine;EINECS 242-914-4;N'-ethyl-N'-(3-methylphenyl)ethane-1,2-diamine;N1-ethyl-N1-(3-methylphenyl)-1,2-ethanediamine;NSC 151043;UNII-VQZ989I52Z;N-(2-aminoethyl)-N-ethyl-3-methylaniline;VQZ989I52Z;DTXSID5027803;NSC-151043;N-Ethyl-N-(.beta.-aminoethyl)-m-toluidine;DTXCID507803;CAS-19248-13-6;NSC151043;N-Ethyl-N-aminoethylaniline;N(CC)(CCN)c1cccc(C)c1;SCHEMBL1029106;CHEMBL3183251;FTMVEUXYYDLYFH-UHFFFAOYSA-;1, N-ethyl-N-(3-methylphenyl)-;Tox21_202192;Tox21_303371;MFCD00025603;STK504396;AKOS000266478;N1-ethyl-N1-m-tolylethane-1,2-diamine;NCGC00249183-01;NCGC00257378-01;NCGC00259741-01;N-ethyl-N-(3-methylphenyl)ethylenediamine;N1-ethyl-N1-m-tolyl-ethane-1,2-diamine;LS-195445;A1284;CS-0206061;FT-0629104;FT-0649076;EN300-21197;D88408;N*1*-ethyl-N*1*-m-tolyl-ethane-1,2-diamine;N*1*-ethyl-N*1* -m-tolyl-ethane-1,2-diamine;N-(2-Aminoethyl)-N-ethyl-m-toluidine, AldrichCPR;Q27291975

Chemical Property of N-(2-Aminoethyl)-N-ethyl-m-toluidine

Chemical Property:

• Vapor Pressure: 0.00177mmHg at 25°C
• Refractive Index: 1.5550-1.5580
• Boiling Point: 293°Cat760mmHg
• PKA: 9.44±0.10(Predicted)
• Flash Point: 118.7°C
• PSA: 29.26000
• Density: 0.988g/cm³
• LogP: 2.48030
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 178.146998583
• Heavy Atom Count: 13
• Complexity: 136

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-(2-Aminoethyl)-N-ethyl-m-toluidine >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CCN)C1=CC=CC(=C1)C

Technology Process of N-(2-Aminoethyl)-N-ethyl-m-toluidine

There total 9 articles about N-(2-Aminoethyl)-N-ethyl-m-toluidine 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: 82.0%

N-Ethyl-N-(2-propionamidoethyl)-m-toluidine (42816-34-2) → N1-ethyl-N1-(3-methylphenyl)-1,2-ethanediamine (19248-13-6)

Guidance literature:

With sodium hydroxide; In ethanol; water; at 150 ℃; for 9h; under 5171.5 Torr;

DOI:10.1021/jo00199a029

Reference yield:

N-ethyl-m-toulidine (102-27-2) → N1-ethyl-N1-(3-methylphenyl)-1,2-ethanediamine (19248-13-6)

Guidance literature:

Multi-step reaction with 2 steps

1: N-Ethyl-m-toluidine hydrochloride / 1 h / 160 °C

2: 82 percent / 10 percent NaOH / H₂O; ethanol / 9 h / 150 °C / 5171.5 Torr

With sodium hydroxide; C₉H₁₃N*ClH; In ethanol; water;

DOI:10.1021/jo00199a029

Reference yield:

→ N1-ethyl-N1-(3-methylphenyl)-1,2-ethanediamine (19248-13-6)

Guidance literature:

With ammonia; nickel; Hydrogenation;

DOI:10.1021/ja01151a037

upstream raw materials:

ethyleneimine

N-ethyl-m-toulidine

N-[2-(N-ethyl-m-toluidino)-ethyl]-phthalimide

N-Ethyl-N-(2-propionamidoethyl)-m-toluidine

Downstream raw materials:

3-[[2-(ethyl-m-tolyl-amino)-ethyl]-({2-[3-methoxy-4-(3-o-tolylureido)phenyl]-acetylamino}-acetyl)-amino]-propionic acid

N-{2-[ethyl(3-methylphenyl)amino]ethyl}-N'-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)urea

N-Aethyl-N-(2-phenylcarbamoylaminoaethyl)-m-toluidin

SB 452533

Refernces

• 1、 -. "2-aminobenzoxazole derivatives and combinatorial libraries thereof". . . Retrieved 2008/06/13.