2-Phenylethanimidamide hydrochloride

Base Information

• Chemical Name: 2-Phenylethanimidamide hydrochloride
• CAS No.: 2498-46-6
• Molecular Formula: C8H10 N2 . Cl H
• Molecular Weight: 170.642
• Hs Code.: 2925290090
• European Community (EC) Number: 815-394-7
• Mol file: 2498-46-6.mol

Synonyms:2498-46-6;2-phenylethanimidamide hydrochloride;2-phenylacetimidamide hydrochloride;2-phenylethanimidamide;hydrochloride;MFCD06761717;phenylacetamidine hydrochloride;2-phenylacetamidine hydrochloride;Benzeneethanimidamide, hydrochloride (1:1);Benzeneethanimidamide, monohydrochloride;2-Phenylacetimidamide HCl;SCHEMBL183500;benzylmethanamidine hydrochloride;2-phenylacetimidamidehydrochloride;2-PHENYLETHANIMIDAMIDE HCL;2-phenyl-acetamidine hydrochloride;UBSBLGBWNYUPDW-UHFFFAOYSA-N;CAA49846;AKOS016899710;AB29087;CS-W005582;SY104493;TS-02321;2-phenylacetoamidine hydrochloric acid salt;FT-0699447;EN300-49888;F19863;A877747;Z600428462

Chemical Property of 2-Phenylethanimidamide hydrochloride

Chemical Property:

• Vapor Pressure: 0.00306mmHg at 25°C
• Melting Point: 145-147 °C
• Boiling Point: 279.6°C at 760 mmHg
• Flash Point: 122.9°C
• PSA: 49.87000
• LogP: 2.76710
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 170.0610761
• Heavy Atom Count: 11
• Complexity: 114

Purity/Quality:

98%min ^*data from raw suppliers

2-PhenylacetimidamideHydrochloride ^*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
• Uses: 2-Phenylacetimidamide Hydrochloride is useful for the preparation of trifluoromethyl pyrimido[1,3]diazepine compounds.

Technology Process of 2-Phenylethanimidamide hydrochloride

There total 4 articles about 2-Phenylethanimidamide hydrochloride 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: 88.0%

ethyl 2-phenylacetimidate hydrochloride (5442-34-2) → 2-phenylacetamidine hydrochloride (2498-46-6)

Guidance literature:

With ammonia; In ethanol; at 0 - 20 ℃;

DOI:10.1016/S0040-4020(01)91478-4

Reference yield: 72.0%

phenylacetonitrile (140-29-4) → 2-phenylacetamidine hydrochloride (2498-46-6)

Guidance literature:

phenylacetonitrile; With trimethylaluminum; ammonium chloride; In toluene; at 0 - 80 ℃; Inert atmosphere;

With hydrogenchloride; In methanol; diethyl ether; chloroform; toluene; at 20 ℃; for 16h;

Reference yield:

methyl phenylacetimidate hydrochloride → 2-phenylacetamidine hydrochloride (2498-46-6)

Guidance literature:

With ammonia; at 20 - 25 ℃; for 20h;

DOI:10.1071/CH9850825

upstream raw materials:

ethyl 2-phenylacetimidate hydrochloride

phenylacetonitrile

Downstream raw materials:

2,6-dibenzyl-5,6,7,8-tetrahydro-3H-pyrido[4,3-d]pyrimidin-4-one

2-amino-3-phenyl-5-nitropyridine

2-(benzyl)-5,6-pentamethylenepyrimidin-4(3H)-one

4-amino-5-phenylpyrimidine

Refernces

• 1、 -. "Pyrimidine Classical Cannabinoid Compounds and Related Methods of Use". Page/Page column 6-7. . Retrieved 2009/12/05.
• 2、 -. "Oxime glucokinase activators". Page/Page column 18. . Retrieved 2008/12/06.