2-(4-chlorophenyl)-N-hydroxyacetimidamide

Base Information

• Chemical Name: 2-(4-chlorophenyl)-N-hydroxyacetimidamide
• CAS No.: 6965-39-5
• Molecular Formula: C8H9 Cl N2 O
• Molecular Weight: 184.625
• Hs Code.: 2925290090
• NSC Number: 67594
• Mol file: 6965-39-5.mol

Synonyms:NSC67594;2-(4-chlorophenyl)-N-hydroxyacetimidamide;2-(4-Chloro-phenyl)-N-hydroxy-acetamidine;SCHEMBL14827527;NSC-67594;AKOS004114621;(z)-2-(4-chlorophenyl)-n'-hydroxyethenimidamide

Chemical Property of 2-(4-chlorophenyl)-N-hydroxyacetimidamide

Chemical Property:

• Melting Point: 103 - 104 °C
• Boiling Point: 366.8°Cat760mmHg
• Flash Point: 175.7°C
• PSA: 58.61000
• Density: 1.31g/cm³
• LogP: 2.32920
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 184.0403406
• Heavy Atom Count: 12
• Complexity: 164

Purity/Quality:

97% ^*data from raw suppliers

(Z)-2-(4-chlorophenyl)-N''-hydroxyacetimidamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CC(=NO)N)Cl
• Isomeric SMILES: C1=CC(=CC=C1C/C(=N\O)/N)Cl

Technology Process of 2-(4-chlorophenyl)-N-hydroxyacetimidamide

There total 8 articles about 2-(4-chlorophenyl)-N-hydroxyacetimidamide 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: 83.0%

p-chlorobenzyl cyanide (140-53-4) → 2-(4-chlorophenyl)-N'-hydroxyacetimidamide (6965-39-5)

Guidance literature:

With hydroxylamine hydrochloride; potassium carbonate; In ethanethiol; at 20 - 80 ℃;

Reference yield: 67.0%

→ N-hydroxy-2-(4-chlorophenyl)acetamidine (6965-39-5)

Guidance literature:

With hydroxylamine hydrochloride; sodium carbonate; In ethanol; water; for 6h; Reflux;

Reference yield: 57.0%

p-chlorobenzyl cyanide (140-53-4) → 2-(4-chlorophenyl)-N-hydroxyacetamidine (925252-84-2,6965-39-5)

Guidance literature:

With hydroxylamine hydrochloride; potassium carbonate; In ethanol; at 20 ℃; for 7h; Reflux;

DOI:10.1021/jm701613h

upstream raw materials:

4-chlorobenzoyl cyanide

p-chlorobenzyl cyanide

4-Cyanochlorobenzene

Downstream raw materials:

3-(4-chloro-benzyl)-5-methyl-2⁽⁴⁾,5-dihydro-[1,2,4]oxadiazole

{{4-{[3-(4-chlorobenzyl)-1,2,4-oxadiazol-5-yl]methyl}cyclohexyl}}-N,N-dimethyl(phenyl)methanamine

3-(4-chlorobenzyl)-N-ethyl-1,2,4-oxadiazol-5-amine

1-ethyl-3-(3-dimethylaminopropyl)carbodiimide