(E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl ester

Base Information

Chemical Name:(E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl ester
CAS No.:50502-46-0
Molecular Formula:C₁₁H₁₈O₃
Molecular Weight:198.262
Hs Code.:
NSC Number:140634
DSSTox Substance ID:DTXSID60422289
Nikkaji Number:J2.999.305J,J2.323.690G
Mol file:50502-46-0.mol

Synonyms:NSC140634;50502-46-0;DTXSID60422289;NSC-140634;(E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl ester;3-Methyl-5-(3,3-dimethyloxiranyl)-2-pentenoic acid methyl ester

Suppliers and Price of (E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl 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 5 raw suppliers

Chemical Property of (E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl ester

Chemical Property:

Vapor Pressure:0.0212mmHg at 25°C
Boiling Point:250.8°Cat760mmHg
Flash Point:98.7°C
Density:0.992g/cm³
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:198.125594432
Heavy Atom Count:14
Complexity:253

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CC(=O)OC)CCC1C(O1)(C)C
Isomeric SMILES:C/C(=C\C(=O)OC)/CCC1C(O1)(C)C

Technology Process of (E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl ester

There total 3 articles about (E)-3,7-Dimethyl-6,7-epoxy-2-octenoic acid methyl 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: 99.0%

: 1189-09-9
methyl geranate

: 50502-46-0
methyl (E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enoate

Guidance literature:: methyl geranate; With MoO(NtBu)(2,6-iPr₂C₆H₃O)2py; In toluene; at 20 ℃; Inert atmosphere;

With tert.-butylhydroperoxide; In decane; toluene; at 90 ℃; for 4h; regioselective reaction; Inert atmosphere;
DOI:10.1016/j.tetlet.2009.07.011

Reference yield: 98.0%

: 1189-09-9,1862-61-9,2349-14-6
methyl geranate

: 50502-46-0
methyl (E)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enoate

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 0 - 20 ℃; for 2.5h; Inert atmosphere;
DOI:10.1039/c6ob01697a