N'-(2-Cyanophenyl)-N,N-dimethylformamidine

Base Information

• Chemical Name: N'-(2-Cyanophenyl)-N,N-dimethylformamidine
• CAS No.: 36185-83-8
• Molecular Formula: C10H11 N3
• Molecular Weight: 173.217
• European Community (EC) Number: 252-903-6
• NSC Number: 319960
• DSSTox Substance ID: DTXSID401249277
• Nikkaji Number: J319.578C
• Mol file: 36185-83-8.mol

Synonyms:N'-(2-cyanophenyl)-N,N-dimethylmethanimidamide;36185-83-8;N'-(2-Cyanophenyl)-N,N-dimethylformamidine;1227920-69-5;EINECS 252-903-6;N'-(2-Cyanophenyl)-N,N-dimethylformimidamide;Benzonitrile, 2-dimethylaminomethylenamino-;N'-(2-Cyanophenyl)-N,N-dimethylimidoformamide;NSC319960;SCHEMBL14514562;DTXSID401249277;AKOS034448255;NSC 319960;NSC-319960;N,N-dimethyl-N'-(o-cyanophenyl)formamidine;EN300-36115;(E)-N'-(2-Cyanophenyl)-N,N-dimethylformamidine;2-[(E)-(Dimethylamino)methyleneamino]benzonitrile;N'-(2-Cyanophenyl)-N,N-dimethylimidoformamide #;Methanimidamide, N'-(2-cyanophenyl)-N,N-dimethyl-;W-110872;Z55888476

Chemical Property of N'-(2-Cyanophenyl)-N,N-dimethylformamidine

Chemical Property:

• Boiling Point: 315.8°Cat760mmHg
• Flash Point: 144.8°C
• PSA: 39.39000
• Density: 0.98g/cm³
• LogP: 1.77968
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 173.095297364
• Heavy Atom Count: 13
• Complexity: 224

Purity/Quality:

99% ^*data from raw suppliers

N''-(2-cyanophenyl)-N,N-dimethylmethanimidamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C=NC1=CC=CC=C1C#N

Technology Process of N'-(2-Cyanophenyl)-N,N-dimethylformamidine

There total 10 articles about N'-(2-Cyanophenyl)-N,N-dimethylformamidine 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: 94.0%

N,N-dimethyl-formamide dimethyl acetal (4637-24-5) + anthranilic acid nitrile (1885-29-6) → N'-(2-cyanophenyl)-N,N-dimethylimidoformamide (36185-83-8)

Guidance literature:

at 90 ℃; for 0.25h; Microwave irradiation;

DOI:10.1016/j.tet.2010.04.066

Reference yield: 88.0%

N,N-dimethyl-formamide (68-12-2,33513-42-7) + 3-(hydroxyimino)indolin-2-one (607-28-3,73859-64-0,73859-66-2) → N'-(2-cyanophenyl)-N,N-dimethylimidoformamide (36185-83-8)

Guidance literature:

With trichlorophosphate; at 0 - 70 ℃;

DOI:10.1016/j.tet.2013.12.028

Reference yield:

N,N-dimethyl-formamide (68-12-2,33513-42-7) + anthranilic acid nitrile (1885-29-6) → N'-(2-cyanophenyl)-N,N-dimethylimidoformamide (36185-83-8)

Guidance literature:

With acetic anhydride; In N,N-dimethyl acetamide; toluene; Reflux;

DOI:10.1016/j.bmcl.2018.10.016

upstream raw materials:

N,N-dimethyl-formamide dimethyl acetal

anthranilic acid nitrile

hydroxyimino-N-phenylacetamide

indole-2,3-dione

Downstream raw materials:

N'-(2-cyanophenyl)-N,N-dimethylacetamidine

N-(3,5-dimethoxyphenyl)quinazolin-4-amine

N-(3,4,5-trimethoxyphenyl)quinazolin-4-amine

4-(phenylamino)quinazoline

Refernces

• 1、 -. "Naphthalimide-polyamine conjugate as well as preparation method and application thereof". Paragraph 0030; 0108-0111. . Retrieved 2021/02/10.
• 2、 Le-Nhat-Thuy, Giang,Dinh, Thuy Van,Pham-The, Hai,Nguyen Quang, Hung,Nguyen Thi, Nga,Dang Thi, Tuyet Anh,Hoang Thi, Phuong,Le Thi, Tu Anh,Nguyen, Ha Thanh,Nguyen Thanh, Phuong,Le Duc, Trung,Nguyen, Tuyen Van. "Design, synthesis and evaluation of novel hybrids between 4-anilinoquinazolines and substituted triazoles as potent cytotoxic agents". supporting information. p. 3741 - 3747. Retrieved 2018/10/20.