6-[(Cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one

Base Information

• Chemical Name: 6-[(Cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one
• CAS No.: 19028-72-9
• Molecular Formula: C13H17 N O
• Molecular Weight: 203.284
• Hs Code.: 2925290090
• NSC Number: 128046
• DSSTox Substance ID: DTXSID70864732
• Nikkaji Number: J1.073.604H
• Mol file: 19028-72-9.mol

Synonyms:19028-72-9;2-(cyclohexyliminomethyl)phenol;6-[(cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one;NSC128046;2-[(E)-(cyclohexylimino)methyl]phenol;Salicyliden-cyclohexylamin;Oprea1_047887;SCHEMBL7097029;N-(Salicylidene)-cyclohexylamine;SCHEMBL14337470;DTXSID70864732;2-[(Cyclohexylimino)methyl]phenol;MFCD00482263;STK531230;NSC-128046

Chemical Property of 6-[(Cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one

Chemical Property:

• Vapor Pressure: 4.46E-05mmHg at 25°C
• Boiling Point: 350.2°Cat760mmHg
• Flash Point: 139.5°C
• PSA: 32.59000
• Density: 1.06g/cm³
• LogP: 3.14380
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 203.131014166
• Heavy Atom Count: 15
• Complexity: 209

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)N=CC2=CC=CC=C2O

Technology Process of 6-[(Cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one

There total 15 articles about 6-[(Cyclohexylamino)methylidene]cyclohexa-2,4-dien-1-one 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: 100.0%

(E)-2-((butylimino)methyl)phenol (2565-54-0) + cyclohexylamine (108-91-8,157973-60-9) → N-(2-hydroxybenzylidene)cyclohexylamine (19028-72-9) + N-butylamine (109-73-9,85404-21-3)

Guidance literature:

In [D₃]acetonitrile; at 25 ℃; Equilibrium constant; Molecular sieve;

DOI:10.1016/j.tet.2020.131128

Reference yield: 100.0%

cyclohexylamine (108-91-8,157973-60-9) + salicylaldehyde (90-02-8) → N-(2-hydroxybenzylidene)cyclohexylamine (19028-72-9)

Guidance literature:

In [D₃]acetonitrile; at 25 ℃; Molecular sieve;

DOI:10.1016/j.tet.2020.131128

Reference yield: 98.0%

cyclohexylamine (108-91-8,157973-60-9) + salicylaldehyde (90-02-8) → N-cyclohexylsalicylideneamine (19028-72-9)

Guidance literature:

In ethanol; at 20 ℃;

DOI:10.1515/znb-2008-0707

upstream raw materials:

2-methyl-benzyl alcohol

cyclohexylamine

N-[(1E)-pyridin-2-ylmethylidene]benzenemethanamine

2-[(E)-(n-propylimino)methyl]phenol

Downstream raw materials:

(E)-2-((butylimino)methyl)phenol

cyclohexylamine

[Mn(III)Cl(N-c-Hxsai)2]

WOCl₃(OHC₆H₄CHNC₆H₁₁)2