7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene

Base Information

Chemical Name:7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene
CAS No.:70713-02-9
Molecular Formula:C13H14N2O
Molecular Weight:214.267
Hs Code.:
DSSTox Substance ID:DTXSID50500545
Nikkaji Number:J861.890I

Synonyms:70713-02-9;7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene;DTXSID50500545

Suppliers and Price of 7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:214.110613074
Heavy Atom Count:16
Complexity:300

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C=C2C3CCC2N=N3

Technology Process of 7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene

There total 5 articles about 7-[(4-Methoxyphenyl)methylidene]-2,3-diazabicyclo[2.2.1]hept-2-ene 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: 83.0%

: 4-(S,S-dimethylsulfoximino)-10-(4-methoxybenzylidene)-2,4,6-triaza[5.2.2.0^2,6]tricyclodecane-3,5-dione

: 70713-02-9
7-(4-methoxy-benzylidene)-2,3-diaza-bicyclo[2.2.1]hept-2-ene

Guidance literature:: With potassium phosphate; at 85 ℃; for 3h;
DOI:10.1021/jo970011j

Reference yield:

: 38068-98-3
6-(4-methoxyphenyl)fulvene

: 70713-02-9
7-(4-methoxy-benzylidene)-2,3-diaza-bicyclo[2.2.1]hept-2-ene

Guidance literature:: Multi-step reaction with 3 steps

1: cyclohexane / 12 h / 20 °C

2: H₂ / Pd/C / ethyl acetate / 0.5 h

3: 1.) KOH, 2.) aq. NH₃, aq. CuCl₂ / 1.) propan-2-ol, reflux, 3 h, 2.) CH₂Cl₂, 0 deg C, 30 min

With potassium hydroxide; ammonium hydroxide; hydrogen; copper dichloride; palladium on activated charcoal; In cyclohexane; ethyl acetate;
DOI:10.1039/a708236c

Reference yield:

: 7-(4-Methoxy-benzylidene)-2,3-diaza-bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid diethyl ester

: 70713-02-9
7-(4-methoxy-benzylidene)-2,3-diaza-bicyclo[2.2.1]hept-2-ene

Guidance literature:: Multi-step reaction with 2 steps

1: H₂ / Pd/C / ethyl acetate / 0.5 h

2: 1.) KOH, 2.) aq. NH₃, aq. CuCl₂ / 1.) propan-2-ol, reflux, 3 h, 2.) CH₂Cl₂, 0 deg C, 30 min

With potassium hydroxide; ammonium hydroxide; hydrogen; copper dichloride; palladium on activated charcoal; In ethyl acetate;
DOI:10.1039/a708236c