tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate

Base Information

Chemical Name:tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate
CAS No.:115270-12-7
Molecular Formula:C₁₁H₁₉NO₂
Molecular Weight:197.277
Hs Code.:
DSSTox Substance ID:DTXSID701174063
Mol file:115270-12-7.mol

Synonyms:115270-12-7;Carbamic acid, 2,4-hexadienyl-, 1,1-dimethylethyl ester, (E,E)- (9CI);tert-butyl N-[(2E,4E)-hexa-2,4-dienyl]carbamate;tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate;DTXSID701174063;Carbamic acid, 2,4-hexadienyl-, 1,1-dimethylethyl ester, (E,E)-;Carbamic acid,2,4-hexadienyl-,1,1-dimethylethyl ester,(E,E)-(9ci);Carbamic acid, 2,4-hexadienyl-, 1,1-dimethylethyl ester, (E,E)-(9CI)

Suppliers and Price of tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate

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 2 raw suppliers

Chemical Property of tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate

Chemical Property:

PSA：38.33000
LogP:3.03430
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:197.141578849
Heavy Atom Count:14
Complexity:224

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC=CC=CCNC(=O)OC(C)(C)C
Isomeric SMILES:C/C=C/C=C/CNC(=O)OC(C)(C)C

Technology Process of tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate

There total 3 articles about tert-Butyl (2E,4E)-hexa-2,4-dien-1-ylcarbamate 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: 78.0%

: 872672-18-9
tert-butyl ((2E,4E)-hexa-2,4-dien-1-yl) carbonate

: 4248-19-5
tert-butyl carbazate

: 1170045-52-9
C₁₁H₁₉NO₂

: 115270-12-7
1-<(tert-butoxycarbonyl)amino>-2(E),4(E)-hexadiene

Guidance literature:: With C₄₈H₄₇IrNO₄P; In diethyl ether; at 20 ℃; optical yield given as %ee; enantioselective reaction; Inert atmosphere;
DOI:10.1021/ol901151u

Reference yield: 76.0%

: 17102-64-6
Sorbyl alcohol

: 216959-34-1
ethyl 2-{[(tert-butoxy)carbonyl]amino}-2-oxoacetate

: 115270-12-7
1-<(tert-butoxycarbonyl)amino>-2(E),4(E)-hexadiene

Guidance literature:: Sorbyl alcohol; ethyl 2-{[(tert-butoxy)carbonyl]amino}-2-oxoacetate; With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;

With lithium hydroxide; In tetrahydrofuran; water; at 20 ℃; regioselective reaction; Inert atmosphere;
DOI:10.1021/acs.joc.1c00918