Dimethyl cis,trans-muconate

Base Information

Chemical Name:Dimethyl cis,trans-muconate
CAS No.:692-92-2
Molecular Formula:C8H10O4
Molecular Weight:170.165
Hs Code.:2917190090
European Community (EC) Number:651-442-1
NSC Number:100909
UNII:FZ659P7T2P
Wikidata:Q27278329
Mol file:692-92-2.mol

Synonyms:Dimethyl cis,trans-muconate;Dimethyl (E,E)-muconate;UNII-FZ659P7T2P;FZ659P7T2P;692-92-2;Muconic acid (2E,4E)-form dimethyl ester [MI];2,4-Hexadienedioic acid, dimethyl ester, (E,E)-;2,4-Hexadienedioic acid, 1,6-dimethyl ester, (2E,4E)-;Dimethyl (E,Z)-muconate;2,4-Hexadienedioic acid, dimethyl ester, (E,Z)-;(E,Z)-dimethyl muconate;SCHEMBL820946;DIMETHYL MUCONATE, (E,Z)-;NSC100909;NSC-100909;Q27278329;MUCONIC ACID (2E,4Z)-FORM DIMETHYL ESTER [MI];(1E,3Z)-1,3-Butadiene-1,4-dicarboxylic acid dimethyl ester;2,4-HEXADIENEDIOIC ACID, 1,6-DIMETHYL ESTER, (2E,4Z)-;1733-37-5

Suppliers and Price of Dimethyl cis,trans-muconate

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 Dimethyl cis,trans-muconate

Chemical Property:

PSA：52.60000
LogP:0.44480
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:170.05790880
Heavy Atom Count:12
Complexity:191

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Dimethyl cis,trans-muconate

There total 3 articles about Dimethyl cis,trans-muconate 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: 3.0%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 74-86-2,25067-58-7
acetylene

: 692-91-1,692-92-2,1119-43-3,1733-37-5
cis,cis-dimethyl muconate

: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

: 624-49-7
dimethylfumarate

Guidance literature:: PdI₂-KI; at 60 ℃; for 15h; under 19000 Torr;

Reference yield:

: 6214-23-9
methyl (2Z)-3-iodoprop-2-enoate

: 42599-23-5
((E)-2-iodovinyl)cyclohexane

: 692-91-1,692-92-2,1119-43-3,1733-37-5
cis,cis-dimethyl muconate

: 692-92-2
(2Z,4E)-hexa-2,4-dienedioic acid dimethyl ester

: 1119-43-3
(E,E)-hexa-2,4-dienedioic acid dimethyl ester

: 77811-12-2
(2E,4E)-methyl 5-cyclohexylpenta-2,4-dienoate

Guidance literature:: With silver(I) acetate; palladium diacetate; N,N,N',N'-tetramethyl-1,8-diaminonaphthalene; In acetonitrile; at 50 ℃; for 20h; optical yield given as %de; Inert atmosphere;
DOI:10.1002/adsc.200700464

Reference yield:

: 6214-23-9
methyl (2Z)-3-iodoprop-2-enoate

: 42599-23-5
((E)-2-iodovinyl)cyclohexane

: 692-91-1,692-92-2,1119-43-3,1733-37-5
cis,cis-dimethyl muconate

: 692-92-2
(2Z,4E)-hexa-2,4-dienedioic acid dimethyl ester

: 1119-43-3
(E,E)-hexa-2,4-dienedioic acid dimethyl ester

: 77811-12-2
(2E,4E)-methyl 5-cyclohexylpenta-2,4-dienoate

Guidance literature:: With silver(I) acetate; palladium diacetate; N,N,N',N'-tetramethyl-1,8-diaminonaphthalene; In acetonitrile; at 50 ℃; for 20h; optical yield given as %de; Inert atmosphere;
DOI:10.1002/adsc.200700464