3-Nitrobenzaldehyde phenylhydrazone

Base Information

• Chemical Name: 3-Nitrobenzaldehyde phenylhydrazone
• CAS No.: 7539-23-3
• Molecular Formula: C13H11N3O2
• Molecular Weight: 241.249
• European Community (EC) Number: 659-994-5
• ChEMBL ID: CHEMBL307304
• Mol file: 7539-23-3.mol

Synonyms:CHEMBL307304;3-Nitrobenzaldehyde phenylhydrazone;BDBM50279922;STK864447;AKOS004902033;1-(3-nitrobenzylidene)-2-phenylhydrazine;(1E)-1-(3-nitrobenzylidene)-2-phenylhydrazine;N-[1-(3-Nitro-phenyl)-meth-(E)-ylidene]-N''-phenyl-hydrazine

Chemical Property of 3-Nitrobenzaldehyde phenylhydrazone

Chemical Property:

• Vapor Pressure: 1.2E-06mmHg at 25°C
• Boiling Point: 401.2°Cat760mmHg
• Flash Point: 196.5°C
• Density: 1.2g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 241.085126602
• Heavy Atom Count: 18
• Complexity: 295

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NN=CC2=CC(=CC=C2)[N+](=O)[O-]
• Isomeric SMILES: C1=CC=C(C=C1)N/N=C/C2=CC(=CC=C2)[N+](=O)[O-]

Technology Process of 3-Nitrobenzaldehyde phenylhydrazone

There total 6 articles about 3-Nitrobenzaldehyde phenylhydrazone 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: 97.0%

3-nitro-benzaldehyde (99-61-6) + phenylhydrazine (100-63-0) → 1-(3-nitrobenzylidene)-2-phenylhydrazine (7539-23-3)

Guidance literature:

In neat (no solvent); at 20 ℃; for 0.0111111h;

DOI:10.1016/j.molcata.2014.06.024

Reference yield: 86.0%

phenylhydrazine hydrochloride (59-88-1) + 3-nitro-benzaldehyde (99-61-6) → 1-(3-nitrobenzylidene)-2-phenylhydrazine (7539-23-3)

Guidance literature:

With sodium acetate; In ethanol; water; for 2h; Reflux;

DOI:10.1016/j.tetlet.2008.10.145

Reference yield: 80.0%

3-Nitrobenzyl alcohol (619-25-0) + phenylhydrazine (100-63-0) → 1-(3-nitrobenzylidene)-2-phenylhydrazine (7539-23-3)

Guidance literature:

3-Nitrobenzyl alcohol; With chromium(VI) oxide; silica gel; In tert-butyl alcohol; for 0.166667h;

phenylhydrazine; In tert-butyl alcohol; for 0.166667h;

DOI:10.1081/SCC-200058009

upstream raw materials:

N-(3-nitro-benzyl)-N-phenyl-hydrazine

3-nitro-benzaldehyde

phenylhydrazine

3-Nitrobenzyl chloride

Downstream raw materials:

acetic acid-[(3-nitro-benzylidene)-phenyl-hydrazide]

3-nitro-benzaldehyde semicarbazone

3-nitro-α-phenylazo-benzaldehyde-oxime

(3,α-dinitro-benzylidene)-phenyl-hydrazine