(NE)-N-[1-[3,5-bis[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

Base Information

• Chemical Name: (NE)-N-[1-[3,5-bis[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine
• CAS No.: 65382-85-6
• Molecular Formula: C12H15N3O3
• Molecular Weight: 249.269
• NSC Number: 295550
• DSSTox Substance ID: DTXSID00429717

Synonyms:NSC295550;65382-85-6;SCHEMBL11318302;DTXSID00429717;NSC-295550

Chemical Property of (NE)-N-[1-[3,5-bis[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

Chemical Property:

• Boiling Point: 521.1°Cat760mmHg
• Flash Point: 349.5°C
• Density: 1.24g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 249.11134135
• Heavy Atom Count: 18
• Complexity: 308

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NO)C1=CC(=CC(=C1)C(=NO)C)C(=NO)C
• Isomeric SMILES: C/C(=N\O)/C1=CC(=CC(=C1)/C(=N/O)/C)/C(=N/O)/C

Technology Process of (NE)-N-[1-[3,5-bis[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine

There total 1 articles about (NE)-N-[1-[3,5-bis[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]ethylidene]hydroxylamine 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: 98.0%

1,3,5-triacetylbenzene (779-90-8) → N-(1-{3,5-bis[1-(hydroxyimino)ethyl]phenyl}ethylidene)hydroxylamine (65382-85-6)

Guidance literature:

With pyridine; hydroxylamine hydrochloride; at 75 ℃; for 0.5h;

DOI:10.1002/anie.200704021

Reference yield: 85.0%

N-(1-{3,5-bis[1-(hydroxyimino)ethyl]phenyl}ethylidene)hydroxylamine (65382-85-6) → 1-[3,5-bis(1-aminoethyl)phenyl]ethan-1-amine (108903-62-4)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; for 2h; atmospheric pressure;

DOI:10.1002/anie.200704021

Reference yield: 27.9%

N-(1-{3,5-bis[1-(hydroxyimino)ethyl]phenyl}ethylidene)hydroxylamine (65382-85-6) + Methacryloyl chloride (920-46-7,26937-45-1) → 1,3,5-triacetylbenzene 1,3,5-tris(O-methacryloyl)trioxime

Guidance literature:

With triethylamine; at -30 - 20 ℃; for 24h;

DOI:10.1039/c5ra00574d

upstream raw materials:

1,3,5-triacetylbenzene

Downstream raw materials:

1-[3,5-bis(1-aminoethyl)phenyl]ethan-1-amine

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