2-Chlorobenzimidamide

Base Information

• Chemical Name: 2-Chlorobenzimidamide
• CAS No.: 45743-05-3
• Molecular Formula: C7H7ClN2
• Molecular Weight: 154.599
• Hs Code.: 2925290090
• European Community (EC) Number: 696-507-5
• DSSTox Substance ID: DTXSID90372400
• Wikidata: Q82160091
• Mol file: 45743-05-3.mol

Synonyms:2-Chlorobenzimidamide;45743-05-3;2-CHLORO-BENZAMIDINE;2-chlorobenzenecarboximidamide;2-chlorobenzamidine;2-chlorobenzene-1-carboximidamide;Benzenecarboximidamide, 2-chloro-;benzamidine chloride;SCHEMBL948047;DTXSID90372400;MXVMRHIWTSFDPU-UHFFFAOYSA-N;MFCD05662890;AKOS005203419;SS-4420;CS-0313521;FT-0738296;A826887

Chemical Property of 2-Chlorobenzimidamide

Chemical Property:

• Vapor Pressure: 0.0218mmHg at 25°C
• Boiling Point: 250.3°C at 760 mmHg
• Flash Point: 105.2°C
• PSA: 49.87000
• Density: 1.29g/cm³
• LogP: 2.42410
• Storage Temp.: 2-8°C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 154.0297759
• Heavy Atom Count: 10
• Complexity: 136

Purity/Quality:

98%min ^*data from raw suppliers

2-Chloro-benzamidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=N)N)Cl
• Uses: 2-Chloro-benzamidine, HCl

Technology Process of 2-Chlorobenzimidamide

There total 3 articles about 2-Chlorobenzimidamide 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: 89.3%

2-Chlorobenzonitrile (873-32-5) → 2-chlorobenzimidamide (45743-05-3)

Guidance literature:

2-Chlorobenzonitrile; With lithium hexamethyldisilazane; In tetrahydrofuran; diethyl ether; Inert atmosphere; Cooling with ice;

With hydrogenchloride; water; In tetrahydrofuran; diethyl ether; Cooling with ice;

With sodium hydroxide; In water; pH=14;

Reference yield:

2-chloro-benzamide oxime (56935-60-5) → 2-chlorobenzimidamide (45743-05-3)

Guidance literature:

With hydrogen; nickel; In ethanol;

DOI:10.1021/jm00309a029

Reference yield:

O-Ethyl-o-chlor-benzimidiumtetrafluorborat → 2-chlorobenzimidamide (45743-05-3)

Guidance literature:

With ammonia; In ethanol;

DOI:10.1021/jo01268a093

upstream raw materials:

2-Chlorobenzonitrile

2-chloro-benzamide oxime

Downstream raw materials:

2-(2-Chloro-phenyl)-5-vinyl-pyrimidine

2,4-diphenyl-1H-imidazole

4,6-dichloro-2-(2-chlorophenyl)-pyrimidine

6-chloro-2-(2-chlorophenyl)benzimidazole

Refernces

• 1、 -. "AMINOPYRIMIDINES USEFUL AS INHIBITORS OF PROTEIN KINASES". Page/Page column 11; 12. . Retrieved 2011/02/18.
• 2、 -. "PYRIMIDINES AND PYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASES". Page/Page column 50. . Retrieved 2009/12/27.