2-(2-Chlorophenyl)ethanamidine

Base Information

• Chemical Name: 2-(2-Chlorophenyl)ethanamidine
• CAS No.: 55154-88-6
• Molecular Formula: C8H9ClN2
• Molecular Weight: 168.62
• Hs Code.: 2925290090
• DSSTox Substance ID: DTXSID40507003
• Wikidata: Q72517125
• Mol file: 55154-88-6.mol

Synonyms:2-(2-CHLOROPHENYL)ETHANAMIDINE;55154-88-6;2-(2-CHLOROPHENYL)ETHANIMIDAMIDE;2-(2-chlorophenyl)acetamidine;MFCD06656686;2-(2-CHLORO-PHENYL)-ACETAMIDINE;(2-Chlorophenyl)ethanimidamide;SCHEMBL2944420;DTXSID40507003;AMY20095;AKOS000196868;CS-11053;SY003979;CS-0038731;FT-0767138;EN300-1263679;A870266

Chemical Property of 2-(2-Chlorophenyl)ethanamidine

Chemical Property:

• Vapor Pressure: 0.00431mmHg at 25°C
• Melting Point: 124-126℃
• Refractive Index: 1.582
• Boiling Point: 278℃
• PKA: 11.74±0.40(Predicted)
• Flash Point: 122℃
• PSA: 49.87000
• Density: 1.24
• LogP: 2.61850
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 168.0454260
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Chlorophenyl)ethanamidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CC(=N)N)Cl

Technology Process of 2-(2-Chlorophenyl)ethanamidine

There total 2 articles about 2-(2-Chlorophenyl)ethanamidine 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:

2-Chlorophenylacetonitrile (2856-63-5) → 2-chlorophenylethanamidine (55154-88-6)

Guidance literature:

With trimethylaluminum; ammonium chloride; In toluene;

DOI:10.1016/S0960-894X(01)00410-3

Reference yield:

→ 2-chlorophenylethanamidine (55154-88-6)

Guidance literature:

entspr. 'Ethylacetamidat', HCl;

Reference yield: 83.0%

CYANAMID (420-04-2) + 2-chlorophenylethanamidine (55154-88-6) → N-cyano-2-(2-chlorophenyl)acetamidine (78622-05-6)

Guidance literature:

In ethanol; water;

upstream raw materials:

2-Chlorophenylacetonitrile

Downstream raw materials:

5-chloro-3-(2-chloro-benzyl)-[1,2,4]thiadiazole

N-cyano-2-(2-chlorophenyl)acetamidine

4-acetylamino-N-[3-(2-chloro-benzyl)-[1,2,4]thiadiazol-5-yl]-benzenesulfonamide

4-amino-N-[3-(2-chloro-benzyl)-[1,2,4]thiadiazol-5-yl]-benzenesulfonamide