2-(3-Chlorophenyl)ethanimidamide hydrochloride

Base Information

• Chemical Name: 2-(3-Chlorophenyl)ethanimidamide hydrochloride
• CAS No.: 6487-96-3
• Molecular Formula: C₈H₉ClN₂*ClH
• Molecular Weight: 205.087
• Hs Code.: 2925290090
• DSSTox Substance ID: DTXSID90589415
• Mol file: 6487-96-3.mol

Synonyms:2-(3-chlorophenyl)ethanimidamide hydrochloride;6487-96-3;2-(3-Chlorophenyl)acetimidamide hydrochloride;2-(3-chlorophenyl)ethanimidamide;hydrochloride;2-(3-chlorophenyl)acetamidine hydrochloride;2-(3-Chlorophenyl)acetimidamidehydrochloride;SCHEMBL1300686;DTXSID90589415;SSKYLHULHCUDLD-UHFFFAOYSA-N;MFCD08752483;2-(3-Chlorophenyl)ethanimidamide HCl;AKOS015846275;SB15454;BS-38367;DB-329235;CS-0454527;2-(3-Chloro-phenyl)-acetamidine hydrochloride;(3-Chlorophenyl)ethanimidamide--hydrogen chloride (1/1)

Chemical Property of 2-(3-Chlorophenyl)ethanimidamide hydrochloride

Chemical Property:

• PSA: 49.87000
• LogP: 3.42050
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 204.0221037
• Heavy Atom Count: 12
• Complexity: 147

Purity/Quality:

97% ^*data from raw suppliers

2-(3-chlorophenyl)ethanimidamidehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-(3-Chlorophenyl)ethanimidamide hydrochloride

There total 3 articles about 2-(3-Chlorophenyl)ethanimidamide 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: 74.0%

3-chloro-benzeneacetonitrile (1529-41-5) → 3-Chlorophenylacetamidine hydrochloride (6487-96-3)

Guidance literature:

3-chloro-benzeneacetonitrile; With trimethylaluminum; ammonium chloride; In toluene; at 80 ℃; for 16h; Inert atmosphere;

With hydrogenchloride; In methanol;

Reference yield:

ethyl m-chlorophenylimidoacetate hydrochloride (103754-13-8) → 2-(3-chlorophenyl)ethaneimidamide hydrochloric acid salt (6487-96-3)

Guidance literature:

With ammonia; In isopropyl alcohol; for 12h;

Reference yield:

3-chloro-benzeneacetonitrile (1529-41-5) → 2-(3-chlorophenyl)ethaneimidamide hydrochloric acid salt (6487-96-3)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride / 1,4-dioxane / 12 h / 20 °C

2: ammonia / isopropyl alcohol / 12 h

With hydrogenchloride; ammonia; In 1,4-dioxane; isopropyl alcohol;

upstream raw materials:

3-chloro-benzeneacetonitrile

ethyl m-chlorophenylimidoacetate hydrochloride

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