(2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile

Base Information

Chemical Name:(2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile
CAS No.:5299-99-0
Molecular Formula:C₁₅H₂₁N
Molecular Weight:215.338
Hs Code.:
DSSTox Substance ID:DTXSID101140965

Synonyms:(2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile;1155402-76-8;DTXSID101140965;(2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4-pentadienenitrile;5299-99-0

Suppliers and Price of (2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile

Supply Marketing:

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

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Chemical Property of (2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:215.167399674
Heavy Atom Count:16
Complexity:396

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C(CCC1)(C)C)C=CC(=CC#N)C
Isomeric SMILES:CC1=C(C(CCC1)(C)C)/C=C/C(=C\C#N)/C

Technology Process of (2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile

There total 14 articles about (2Z,4E)-3-Methyl-5-(2,6,6-trimethyl-1-cyclohexen-1-yl)penta-2,4-dienenitrile 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: 92.0%

: 917-54-4
methyllithium

: 173214-57-8
(E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile

: 5299-99-0
(2Z,4E)-3-methyl-5-(2’,6’,6’-trimethylcyclohex-1’-en-1’-yl)-penta-2,4-dienenitrile

Guidance literature:: With copper(l) iodide; In tetrahydrofuran; diethyl ether; at -78 ℃; for 0.75h;
DOI:10.1021/jo952189g

Reference yield:

: 94326-16-6
(E)-3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-1-en-1-yl)pent-4-enenitrile

: 5299-99-0
(2Z,4E)-3-methyl-5-(2’,6’,6’-trimethylcyclohex-1’-en-1’-yl)-penta-2,4-dienenitrile

: 5299-98-9
(2E,4E)-3-methyl-5-(2,6,6-trimethyl-cyclohex-1-enyl)-penta-2,4-dienenitrile

Guidance literature:: With toluene-4-sulfonic acid; In toluene; Overall yield = 95 %; Overall yield = 352 mg; Reflux; Inert atmosphere;
DOI:10.1016/j.ejmech.2013.09.057

Reference yield:

: 2537-48-6
diethyl 1-cyanomethylphosphonate

: 79-77-6,14901-07-6
(E)-β-ionone

: 5299-99-0
(2Z,4E)-3-methyl-5-(2’,6’,6’-trimethylcyclohex-1’-en-1’-yl)-penta-2,4-dienenitrile

: 5299-98-9
(2E,4E)-3-methyl-5-(2,6,6-trimethyl-cyclohex-1-enyl)-penta-2,4-dienenitrile

Guidance literature:: With Amberlyst-26; Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; 1.) MeOH, 2 h, 2.) THF, room temperature, 2 h;