(6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one-nickel (2:1)

Base Information

• Chemical Name: (6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one-nickel (2:1)
• CAS No.: 41754-10-3
• Molecular Formula: C20H26N2NiO2
• Molecular Weight: 385.126
• DSSTox Substance ID: DTXSID801319256
• Mol file: 41754-10-3.mol

Synonyms:41754-10-3;DTXSID801319256;(6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one - nickel (2:1)

Chemical Property of (6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one-nickel (2:1)

Chemical Property:

• Vapor Pressure: 0.00448mmHg at 25°C
• Boiling Point: 277.6°C at 760 mmHg
• Flash Point: 115.8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 384.134770
• Heavy Atom Count: 25
• Complexity: 580

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)NC=C1C=CC=CC1=O.CC(C)NC=C1C=CC=CC1=O.[Ni]
• Isomeric SMILES: CC(N/C=C/1\C(=O)C=CC=C1)C.CC(N/C=C/1\C(=O)C=CC=C1)C.[Ni]

Technology Process of (6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one-nickel (2:1)

There total 5 articles about (6Z)-6-[(Isopropylamino)methylene]-2,4-cyclohexadien-1-one-nickel (2:1) 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:

nickel(II) chloride hexahydrate + 2-Isopropyliminomethylphenol (135609-63-1) → bis(isopropylsalicylaldiminato)nickel(II) (41754-10-3,637004-57-0,35968-67-3)

Guidance literature:

In methanol; at 20 ℃; for 8h;

DOI:10.1016/j.ica.2017.05.035

Reference yield:

bis(3,6-dimethylsalicylaldehydato)nickel(II) (36339-86-3,14263-01-5) + isopropylamine (75-31-0) → bis(isopropylsalicylaldiminato)nickel(II) (41754-10-3,637004-57-0,35968-67-3)

Guidance literature:

In methanol; heating, reflux; drying in vac., recrystn. from cyclohexane;

DOI:10.1021/ja00887a009

Reference yield:

bis(salicylaldehydato)nickel(II) dihydrate + isopropylamine (75-31-0) → C20H24N2NiO2 (35968-67-3,41754-10-3,637004-57-0)

Guidance literature:

In methanol; reflux; evapn. in vac., recrystn. (EtOAc);

DOI:10.1021/ic00132a028

upstream raw materials:

bis(3,6-dimethylsalicylaldehydato)nickel(II)

isopropylamine

2-{[(1-methylethyl)imino]methyl}phenol

nickel dichloride