Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl-

Base Information

• Chemical Name: Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl-
• CAS No.: 203793-57-1
• Molecular Formula: C₁₄H₁₂N₄O₃
• Molecular Weight: 284.274
• DSSTox Substance ID: DTXSID401191967
• Mol file: 203793-57-1.mol

Synonyms:DTXSID401191967;Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl-;203793-57-1

Chemical Property of Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl-

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 284.09094026
• Heavy Atom Count: 21
• Complexity: 386

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N=NC(=NOC(=O)OC2=CC=CC=C2)N
• Isomeric SMILES: C1=CC=C(C=C1)N=N/C(=N/OC(=O)OC2=CC=CC=C2)/N

Technology Process of Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl-

There total 3 articles about Diazenecarboximidamide, N-[(phenoxycarbonyl)oxy]-2-phenyl- 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: 34.0%

phenyl chloroformate (1885-14-9) + phenylazomethanamidoxime (52512-46-6) → O-(phenoxycarbonyl)-phenylazo-methanamidoxime (203793-57-1)

Guidance literature:

With triethylamine; In diethyl ether; for 0.5h;

DOI:10.1002/ardp.19973301207

Reference yield:

aniline (62-53-3) → O-(phenoxycarbonyl)-phenylazo-methanamidoxime (203793-57-1)

Guidance literature:

Multi-step reaction with 3 steps

1: 1) 10percent aq. HCl, NaNO₂ / 1) 0 deg C to 5 deg C, 2) ether, 30 min

2: NH₂OH*HCl, NaOH / diethyl ether; H₂O

3: 34 percent / NEt₃ / diethyl ether / 0.5 h

With hydrogenchloride; sodium hydroxide; hydroxylamine hydrochloride; triethylamine; sodium nitrite; In diethyl ether; water;

DOI:10.1002/ardp.19973301207

Reference yield:

phenyl-diazenecarbonitrile (622-83-3) → O-(phenoxycarbonyl)-phenylazo-methanamidoxime (203793-57-1)

Guidance literature:

Multi-step reaction with 2 steps

1: NH₂OH*HCl, NaOH / diethyl ether; H₂O

2: 34 percent / NEt₃ / diethyl ether / 0.5 h

With sodium hydroxide; hydroxylamine hydrochloride; triethylamine; In diethyl ether; water;

DOI:10.1002/ardp.19973301207

upstream raw materials:

phenyl chloroformate

phenylazomethanamidoxime

aniline

phenyl-diazenecarbonitrile

Refernces