(4-Nitroanilino)azanium;chloride

Base Information

• Chemical Name: (4-Nitroanilino)azanium;chloride
• CAS No.: 636-99-7
• Molecular Formula: C6H7N3O2^.HCl
• Molecular Weight: 189.601
• Hs Code.: 2928000090
• Mol file: 636-99-7.mol

Synonyms:AKOS023093316

Chemical Property of (4-Nitroanilino)azanium;chloride

Chemical Property:

• Appearance/Colour: Light Brown or yellow granular crystals
• Melting Point: 205-207°C
• Boiling Point: 344 °C at 760 mmHg
• Flash Point: 161.8 °C
• PSA: 83.87000
• LogP: 2.97890
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• Solubility.: DMSO, Methanol, Water
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 189.0305042
• Heavy Atom Count: 12
• Complexity: 137

Purity/Quality:

99% ^*data from raw suppliers

4-Nitrophenylhydrazine Hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,T
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39-24/25-22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1N[NH3+])[N+](=O)[O-].[Cl-]
• Uses: 4-Nitrophenylhydrazine is a nitro substituted aryl hydrazine with potential anticancer activity.

Technology Process of (4-Nitroanilino)azanium;chloride

There total 3 articles about (4-Nitroanilino)azanium;chloride 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: 75.0%

3-(4-nitrophenyl)sydnone (6299-51-0) → 4-nitrophenylhydrazine hydrochloride (636-99-7)

Guidance literature:

With hydrogenchloride; In ethyl acetate; at 60 ℃; for 0.25h;

DOI:10.1002/jccs.200000027

Reference yield: 39.0%

4-nitro-aniline (100-01-6,104810-17-5) → 4-nitrophenylhydrazine hydrochloride (636-99-7)

Guidance literature:

4-nitro-aniline; With hydrogenchloride; sodium nitrite; In water; at 0 ℃; for 1h;

With hydrogenchloride; tin(ll) chloride; In water; at 0 ℃; for 2h;

DOI:10.1016/j.bmc.2014.03.016

Reference yield:

(3R,4S)-4-hydroxy-2-oxotetrahydrofuran-3-yl 2-(2-(4-nitrophenyl)hydrazinyl)-2-oxoacetate (1352877-24-7) → 4-nitrophenylhydrazine hydrochloride (636-99-7)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; methanol; at 90 ℃; for 2h;

DOI:10.1016/j.tet.2011.09.146

upstream raw materials:

3-(4-nitrophenyl)sydnone

4-nitro-aniline

(3R,4S)-4-hydroxy-2-oxotetrahydrofuran-3-yl 2-(2-(4-nitrophenyl)hydrazinyl)-2-oxoacetate

Downstream raw materials:

4-methyl-pent-3-en-2-one-(4-nitro-phenylhydrazone)

succinaldehyde bis-(4-nitro-phenylhydrazone)

3-ethyl-4-methyl-1-(4-nitro-phenyl)-1H-pyrazole

phenyl-glyoxal-bis-(4-nitro-phenylhydrazone)

Refernces

• 1、 Jin, Xiao-Yan,Zhang, Kang-Ping,Chen, Hao,Miao, Ting-Ting,Wang, Shi-Fa,Gu, Wen. "Synthesis, in vitro Antimicrobial, and Cytotoxic Activities of New 1,3,4-Oxadiazin-5(6H)-one Derivatives from Dehydroabietic Acid". . p. 538 - 547. Retrieved 2018/06/11.
• 2、 Purohit, Meena K.,Chakka, Sai Kumar,Scovell, Iain,Neschadim, Anton,Bello, Angelica M.,Salum, Norue,Katsman, Yulia,Bareau, Madeleine C.,Branch, Donald R.,Kotra, Lakshmi P.. "Structure-activity relationships of pyrazole derivatives as potential therapeutics for immune thrombocytopenias". . p. 2739 - 2752. Retrieved 2014/05/06.