n'-(3-Nitrobenzylidene)benzohydrazide

Base Information

• Chemical Name: n'-(3-Nitrobenzylidene)benzohydrazide
• CAS No.: 14379-78-3
• Molecular Formula: C₁₄H₁₁N₃O₃
• Molecular Weight: 269.26
• NSC Number: 126737
• DSSTox Substance ID: DTXSID10425927
• Mol file: 14379-78-3.mol

Synonyms:n'-(3-nitrobenzylidene)benzohydrazide;14379-78-3;N'-[(E)-(3-nitrophenyl)methylidene]benzohydrazide;NSC126737;SCHEMBL15917496;DTXSID10425927;BDBM192659;STK083721;AKOS000486087;NSC-126737;BENZOIC (3-NITROBENZYLIDENE)HYDRAZIDE;N’-(3-nitrophenylmethylene)benzohydrazide (1j)

Chemical Property of n'-(3-Nitrobenzylidene)benzohydrazide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.26g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 269.08004122
• Heavy Atom Count: 20
• Complexity: 372

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

Technology Process of n'-(3-Nitrobenzylidene)benzohydrazide

There total 6 articles about n'-(3-Nitrobenzylidene)benzohydrazide 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) + benzoic acid hydrazide (613-94-5) → 1-benzoyl-2-(3-nitrobenzylidene)hydrazine (59394-92-2,14379-78-3)

Guidance literature:

In ethanol; for 4h; Heating;

Reference yield:

C14H13N3O3 → 1-benzoyl-2-(3-nitrobenzylidene)hydrazine (59394-92-2,14379-78-3)

Guidance literature:

With [bis(acetoxy)iodo]benzene; In acetonitrile; at 40 ℃;

DOI:10.1055/s-0034-1379974

Reference yield:

benzoic acid ethyl ester (93-89-0,99341-95-4) → 1-benzoyl-2-(3-nitrobenzylidene)hydrazine (59394-92-2,14379-78-3)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrazine hydrate / ethanol / 12 h / Reflux

2: methanol / 0.5 h / 20 °C

With hydrazine hydrate; In methanol; ethanol;

DOI:10.1016/j.saa.2015.04.025

upstream raw materials:

3-nitro-benzaldehyde

benzoic acid hydrazide

N-benzoylpiperidine

benzoic acid

Downstream raw materials:

2-(3-nitrophenyl)-5-phenyl-1,3,4-oxadiazole

N'-[1-(3-nitrophenyl)but-3-en-1-yl]benzohydrazide

N-(2,2-difluoro-1-(3-nitrophenyl)-3-oxo-3-phenylpropyl)benzohydrazide