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

Base Information

• Chemical Name: N-(2-Cyanoethyl)-N-ethyl-m-toluidine
• CAS No.: 148-69-6
• Molecular Formula: C12H16N2
• Molecular Weight: 188.272
• Hs Code.: 2926909090
• European Community (EC) Number: 205-721-6
• NSC Number: 93794
• UNII: C8HAT3D9UN
• DSSTox Substance ID: DTXSID5051735
• Nikkaji Number: J37.696E
• Wikidata: Q72473908
• Mol file: 148-69-6.mol

Synonyms:148-69-6;3-(Ethyl(m-tolyl)amino)propanenitrile;n-Ethyl-n-cyanoethyl-m-toluidine;N-(2-Cyanoethyl)-N-ethyl-m-toluidine;Propionitrile, 3-(N-ethyl-m-toluidino)-;3-(N-Ethyl-m-toluidino)propiononitrile;m-Toluidine, N-cyanoethyl-N-ethyl-;3-(N-Ethyl-m-toluidino)propionitrite;3-(Ethyl(3-methylphenyl)amino)propanenitrile;N-cyanoethyl-N-ethyl-m-toluidine;3-(N-ethyl-3-methylanilino)propanenitrile;N-Ethylcyano-N-ethyl-m-toluidine;EINECS 205-721-6;NSC 93794;NSC-93794;C8HAT3D9UN;Propanenitrile, 3-(ethyl(3-methylphenyl)amino)-;Propanenitrile, 3-[ethyl(3-methylphenyl)amino]-;BRN 2211104;3-(N-Ethyl-meta-toluidino)-propionitrile;N-Ethyl-N-cyanoethyl-m-methylaniline;3-(N-Ethyl-m-toluidino)propionitrile;NSC93794;n-(b-cyanoethyl)-n-ethyl-m-toluidine;UNII-C8HAT3D9UN;SCHEMBL6889131;DTXSID5051735;N-Ethyl-N-cyanoethyl-3-toluidine;MFCD00019859;AKOS009074422;AC-11605;BS-44037;3-(Ethyl-3-methylanilino)propanenitrile #;LS-120870;3-[Ethyl(3-methylphenyl)amino]propionitrile;C2877;FT-0658300;T70312;N-.BETA.-CYANOETHYL-N-ETHYL-M-TOLUIDINE;N-ETHYL-N-.BETA.-CYANOETHYL-M-TOLUIDINE;Propanonitrilo, 3-[etil (3-metilfenil) amino]-;A808805;M-METHYL-N-(2-CYANOETHYL)-N-ETHYLANILINE;W-108098

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

Chemical Property:

• Vapor Pressure: 0.000102mmHg at 25°C
• Refractive Index: 1.547
• Boiling Point: 337.8 °C at 760 mmHg
• PKA: 5.42±0.50(Predicted)
• Flash Point: 145.1 °C
• PSA: 27.03000
• Density: 1.008 g/cm³
• LogP: 2.73498
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 188.131348519
• Heavy Atom Count: 14
• Complexity: 204

Purity/Quality:

99% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN(CCC#N)C1=CC=CC(=C1)C

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

There total 1 articles about N-(2-Cyanoethyl)-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:

→ N-ethyl-N-(2'-cyanoethyl)-3-toluidine (148-69-6)

Guidance literature:

N-Aethyl-m-toluidin u. Acrylnitril i. Ggw. v. ZnCl2;

Reference yield: 60.0%

N-ethyl-N-(2'-cyanoethyl)-3-toluidine (148-69-6) + 2-amino-8-nitronaphtho[1,2-d]thiazole (320340-92-9) → 3-{ethyl-[3-methyl-4-(5-nitro-naphtho[1,2-d]thiazol-2-ylazo)-phenyl]-amino}-propionitrile

Guidance literature:

2-amino-8-nitronaphtho[1,2-d]thiazole; With nitrosylsulfuric acid; acetic acid; at 5 ℃; for 1h;

N-ethyl-N-(2'-cyanoethyl)-3-toluidine; With sodium acetate; acetic acid; at 10 - 15 ℃; for 0.5h; pH=4.5 - 5.5;

DOI:10.1080/10426500008045246

Reference yield:

4-nitro-2,6-dichloroaniline (99-30-9) + N-ethyl-N-(2'-cyanoethyl)-3-toluidine (148-69-6) → 3-({4-[(2,6-dichloro-4-nitrophenyl)azo]-3-methylphenyl}ethylamino)propiononitrile (63467-11-8)

Guidance literature:

With nitrosylsulfuric acid; sulfuric acid; aminosulfonic acid; In water; acetic acid; propionic acid; at 0 - 20 ℃; for 1h;

Downstream raw materials:

3-({4-[(2,6-dichloro-4-nitrophenyl)azo]-3-methylphenyl}ethylamino)propiononitrile

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