N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide

Base Information

• Chemical Name: N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide
• CAS No.: 372960-11-7
• Molecular Formula: C12H16N2O
• Molecular Weight: 204.272
• Hs Code.: 2928000090
• European Community (EC) Number: 696-251-4
• DSSTox Substance ID: DTXSID00468666
• Mol file: 372960-11-7.mol

Synonyms:372960-11-7;N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide;N'-(2,2-Dimethylpropylidene)benzohydrazide;N-[(E)-2,2-dimethylpropylideneamino]benzamide;SCHEMBL20583693;DTXSID00468666;MFCD19774574;AKOS015991373;EG-0102;CS-0357421;(E)-N'-(2,2-dimethylpropylidene)benzohydrazide;A913717

Chemical Property of N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide

Chemical Property:

• PSA: 41.46000
• LogP: 2.83920
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 204.126263138
• Heavy Atom Count: 15
• Complexity: 235

Purity/Quality:

97% ^*data from raw suppliers

N''-[(1E)-2,2-Dimethylpropylidene]benzohydrazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C=NNC(=O)C1=CC=CC=C1
• Isomeric SMILES: CC(C)(C)/C=N/NC(=O)C1=CC=CC=C1

Technology Process of N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide

There total 1 articles about N'-[(1E)-2,2-dimethylpropylidene]benzohydrazide 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:

→ 3-Pentanone benzoylhydrazone (14850-77-2,15001-59-9) + pivalaldehyde benzoylhydrazone (372960-11-7)

Guidance literature:

Reference yield: 88.0%

4,4,5,5-tetramethyl-2-(1-methyl-2-propenyl)-1,3,2-dioxaborolane (75851-67-1) + pivalaldehyde benzoylhydrazone (372960-11-7) → N'-(1-tert-butyl-2-methyl-3-butenyl)benzohydrazide

Guidance literature:

With indium iodide; In methanol; dichloromethane; at 0 ℃; for 48h; optical yield given as %de; diastereoselective reaction; Inert atmosphere;

DOI:10.1039/b802153h

Reference yield: 85.0%

trimethylsilyl cyanide (7677-24-9) + pivalaldehyde benzoylhydrazone (372960-11-7) → benzoic acid N'-(1-cyano-2,2-dimethyl-propyl)-hydrazide

Guidance literature:

pivalaldehyde benzoylhydrazone; With triethylamine; scandium tris(trifluoromethanesulfonate); In dichloromethane; at 20 ℃; for 0.25h;

trimethylsilyl cyanide; With triethylamine; In dichloromethane; at 20 ℃; for 24h;

DOI:10.1002/adsc.200505272

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