Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester

Base Information

Chemical Name:Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester
CAS No.:63165-90-2
Molecular Formula:C₃₆H₄₅NO₄
Molecular Weight:555.758
Hs Code.:
DSSTox Substance ID:DTXSID0069753
Nikkaji Number:J429.537D

Synonyms:63165-90-2;Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester;Acetic acid, (bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)cyano-, ethyl ester;Acetic acid, 2-(2,3-bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)cyclopropylidene)-2-cyano-, ethyl ester;Ethyl (bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadiene-1-ylidene)cyclopropylidene)cyanoacetate;DTXSID0069753;SCHEMBL11523372;C36H45NO4;C36-H45-N-O4;2-[2,3-Bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]-2-cyanoacetic acid ethyl ester

Suppliers and Price of Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 0 raw suppliers

Chemical Property of Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester

Chemical Property:

Vapor Pressure:3.29E-15mmHg at 25°C
Boiling Point:618.2°C at 760 mmHg
Flash Point:263.1°C
PSA：84.23000
Density:1.141g/cm³
LogP:8.03188
XLogP3:7.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:555.33485892
Heavy Atom Count:41
Complexity:1340

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(=C1C(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C1=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C#N

Technology Process of Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester

There total 3 articles about Acetic acid, [bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]cyclopropylidene]cyano-, ethyl ester 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:

: 64631-51-2
1,2-Bis(3,5-di-tert-butyl-4-hydroxyphenyl)-3-carboethoxycyanomethylenecyclopropene

: 63165-90-2
1,2-Bis(3,5-di-tert-butyl-4-oxo-2,5-cyclohexadien-1-ylidene)-3-carboethoxycyanomethylenecyclopropane

Guidance literature:

Reference yield:

: 14106-41-3
bis(3,5-di-tert-butyl-4-hydroxyphenyl)cyclopropenone

: 105-56-6
ethyl 2-cyanoacetate

: 63165-90-2
1,2-Bis(3,5-di-tert-butyl-4-oxo-2,5-cyclohexadien-1-ylidene)-3-carboethoxycyanomethylenecyclopropane

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydrogencarbonate / water; acetic anhydride; benzene

With sodium hydrogencarbonate; In water; acetic anhydride; benzene;