2-Butanone, 2-(4-nitrophenyl)hydrazone

Base Information

• Chemical Name: 2-Butanone, 2-(4-nitrophenyl)hydrazone
• CAS No.: 1017-79-4
• Molecular Formula: C₁₀H₁₃N₃O₂
• Molecular Weight: 207.232
• European Community (EC) Number: 668-615-2
• DSSTox Substance ID: DTXSID001296569
• Mol file: 1017-79-4.mol

Synonyms:2-Butanone, 2-(4-nitrophenyl)hydrazone;Butanon-p-Nitrophenylhydrazon;1017-79-4;SCHEMBL11401425;DTXSID001296569

Chemical Property of 2-Butanone, 2-(4-nitrophenyl)hydrazone

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 207.100776666
• Heavy Atom Count: 15
• Complexity: 240

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=NNC1=CC=C(C=C1)[N+](=O)[O-])C

Technology Process of 2-Butanone, 2-(4-nitrophenyl)hydrazone

There total 2 articles about 2-Butanone, 2-(4-nitrophenyl)hydrazone 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:

4-nitro-aniline (100-01-6,104810-17-5) → butan-2-one-(4-nitro-phenylhydrazone) (1017-79-4,41902-45-8,41902-46-9)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride; sodium nitrite

2: acetic acid / ethanol

With hydrogenchloride; acetic acid; sodium nitrite; In ethanol;

DOI:10.1055/s-0031-1290565

Reference yield:

4-nitrophenylhydrazone (100-16-3) + butanone (78-93-3) → butan-2-one-(4-nitro-phenylhydrazone) (1017-79-4,41902-45-8,41902-46-9)

Guidance literature:

With acetic acid;

Reference yield: 60.0%

butan-2-one-(4-nitro-phenylhydrazone) (1017-79-4,41902-45-8,41902-46-9) → 5-Ethyl-2-(4-nitro-phenyl)-[1,2,3]thiadiazol-2-ium; chloride

Guidance literature:

With thionyl chloride; for 1h; Heating;

DOI:10.1007/BF00481528

upstream raw materials:

4-nitrophenylhydrazone

butanone

4-nitro-aniline

Downstream raw materials:

2,3-Dimethyl-5-nitro-1H-indole

1-ethyl-2,3-bis-(p-nitrophenylhydrazono)propyl acetate

5-amino-2,3-dimethylindole

C₁₇H₁₈N₂

Refernces

• 1、 Ramesh, Subburethinam,Nagarajan, Rajagopal. "One-pot synthesis of pyrrolo[3,2-f]-and pyrrolo[2,3-h]quinoline derivatives: Observation of an unexpected mechanistic pathway". supporting information; scheme or table. p. 717 - 722. Retrieved 2012/07/03.