1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine

Base Information

• Chemical Name: 1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine
• CAS No.: 5347-98-8
• Molecular Formula: C8H9N6O4+
• Molecular Weight: 252.189
• NSC Number: 1526
• Mol file: 5347-98-8.mol

Synonyms:5347-98-8;1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine;NSC1526;NSC-1526;STL581916;AKOS003211867;1-NITRO-3-[(0-NITROBENZYLIDENE)AMINO]GUANIDINE;(2E)-N-nitro-2-(2-nitrobenzylidene)hydrazinecarboximidamide

Chemical Property of 1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 252.06070276
• Heavy Atom Count: 18
• Complexity: 371

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine

There total 2 articles about 1-nitro-2-[(E)-(2-nitrophenyl)methylideneamino]guanidine 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%

1-amino-2-nitroguanidine (18264-75-0) + 2-nitro-benzaldehyde (552-89-6) → 2-(2'-nitrobenzylidene)-N'-nitrohydrazinecarboximidamide (5347-98-8)

Guidance literature:

With acetic acid; In ethanol; at 65 ℃; Reflux;

Reference yield:

2-nitro-benzaldehyde (552-89-6) + 3-amino-1-nitroguanidine (18264-75-0) → N-nitro-N'-(2-nitro-benzylidenamino)-guanidine (5347-98-8)

Guidance literature:

Reference yield: 73.0%

2-(2'-nitrobenzylidene)-N'-nitrohydrazinecarboximidamide (5347-98-8) → C14H12ClN7O4 (1376342-39-0)

Guidance literature:

2-(2'-nitrobenzylidene)-N'-nitrohydrazinecarboximidamide; With sodium hydride; potassium iodide; In N,N-dimethyl-formamide; at 10 ℃; for 1h;

2-chloro-5-(halomethyl)pyridine; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1021/jf300616x

upstream raw materials:

2-nitro-benzaldehyde

3-amino-1-nitroguanidine

1-amino-2-nitroguanidine

Downstream raw materials:

2-(2'-nitrobenzylidene)-N-propyl-N'-nitrohydrozinecarboximidamides

C₁₄H₁₂ClN₇O₄