BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE

Base Information

• Chemical Name: BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE
• CAS No.: 17473-76-6
• Molecular Formula: C13H11 Cl N2 O
• Molecular Weight: 246.696
• Hs Code.: 2928000090
• DSSTox Substance ID: DTXSID10169894
• Nikkaji Number: J436.496A
• Wikidata: Q83039692
• Pharos Ligand ID: QGCF6PU69UYN
• ChEMBL ID: CHEMBL347267
• Mol file: 17473-76-6.mol

Synonyms:N'-(4-chlorophenyl)benzohydrazide;17473-76-6;BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE;Benzoic (p-chlorophenyl)hydrazide;BRN 0653306;Benzoic acid, 2-(4-chlorophenyl)hydrazide;CHEMBL347267;DTXSID10169894;N/'-(4-Chlorophenyl)benzohydrazide;BDBM50086489;AKOS000279615;2-(4-Chlorophenyl)hydrazide benzoic acid;LS-36609;FT-0608628;Benzoic acid N''-(4-chloro-phenyl)-hydrazide;SR-01000029130;SR-01000029130-1

Chemical Property of BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE

Chemical Property:

• Vapor Pressure: 7.69E-05mmHg at 25°C
• Boiling Point: 342.1°Cat760mmHg
• Flash Point: 160.7°C
• PSA: 44.62000
• Density: 1.304g/cm³
• LogP: 3.74470
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 246.0559907
• Heavy Atom Count: 17
• Complexity: 246

Purity/Quality:

98% ^*data from raw suppliers

2-(4-CHLOROPHENYL)HYDRAZIDEBENZOIC ACID 95.00% ^*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(=O)NNC2=CC=C(C=C2)Cl

Technology Process of BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE

There total 11 articles about BENZOIC ACID, 2-(p-CHLOROPHENYL)HYDRAZIDE 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: 57.0%

4-chlorophenyldiazonium salt (17333-85-6) + benzil (134-81-6) → 2-[(4-Chloro-phenyl)-hydrazono]-1,2-diphenyl-ethanone + 1,1-dibenzoyl-2-(p-chlorophenyl)hydrazine (136953-41-8) + N'-(4-chlorophenyl)benzohydrazide (17473-76-6)

Guidance literature:

With titanium(III) chloride; In acetic acid; for 0.666667h; Ambient temperature;

DOI:10.1021/jo00024a021

Reference yield: 47.0%

4-chlorophenylhydrazine hydrochloride (1073-70-7) + benzoic acid anhydride (93-97-0) → N'-(4-chlorophenyl)benzohydrazide (17473-76-6)

Guidance literature:

With sodium hydrogencarbonate; In isopropyl alcohol; for 1h; Heating;

DOI:10.1021/je00039a036

Reference yield: 35.0%

4-chlorophenylhydrazine hydrochloride (1073-70-7) + benzoic acid (65-85-0,8013-63-6) → N'-(4-chlorophenyl)benzohydrazide (17473-76-6)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; Inert atmosphere;

DOI:10.1039/c4ob02343a

upstream raw materials:

benzoyl chloride

N-4-chlorophenylhydrazine

ethanol

phenylhydrazine

Downstream raw materials:

benzoyl-(4-chloro-phenyl)-diazene

Bis-<α-(4-chlorphenyl)-β-benzoyl-hydrazino>-methan

1-(4-chlorophenyl)-3-methyl-1H-indazole

(Z)-N'-(4-chlorophenyl)benzohydrazonoyl chloride

Refernces

• 1、 Voronin, Vladimir V.,Ledovskaya, Maria S.,Gordeev, Evgeniy G.,Rodygin, Konstantin S.,Ananikov, Valentine P.. "[3+2]-cycloaddition of in situ generated nitrile imines and acetylene for assembling of 1,3-disubstituted pyrazoles with quantitative deuterium labeling". . p. 3819 - 3828. Retrieved 2018/04/14.
• 2、 Wang, Wei-Juan,Zhang, Ting,Duan, Li-Jun,Zhang, Xue-Jing,Yan, Ming. "KOt-Bu promoted homocoupling and decomposition of N'-aryl acylhydrazines: synthesis of unsymmetric N',N'-diaryl acylhydrazines". . p. 9073 - 9080. Retrieved 2015/11/09.