Wyerone

Base Information

Chemical Name:Wyerone
CAS No.:20079-30-5
Deprecated CAS:3455-89-8
Molecular Formula:C15H14O4
Molecular Weight:258.2693
Hs Code.:
UNII:J61878UBBT
DSSTox Substance ID:DTXSID801129316
Nikkaji Number:J15.493H
Wikidata:Q27108564
Metabolomics Workbench ID:69950
Mol file:20079-30-5.mol

Synonyms:Wyerone;20079-30-5;UNII-J61878UBBT;J61878UBBT;C08465;2-Furanacrylic acid, 5-(4-hepten-2-ynoyl)-, methyl ester, (E,Z)-;methyl (E)-3-[5-[(Z)-hept-4-en-2-ynoyl]furan-2-yl]prop-2-enoate;2-Propenoic acid, 3-(5-(1-oxo-4-hepten-2-ynyl)-2-furanyl)-, methyl ester, (E,Z)-;3-(5-hept-4-en-2-ynoyl-furan-2-yl)-acrylic acid methyl ester;methyl (2E)-3-{5-[(4Z)-hept-4-en-2-ynoyl]-2-furyl}acrylate;2-propenoic acid, 3-[5-[(4Z)-1-oxo-4-hepten-2-ynyl]-2-furanyl]-, methyl ester, (2E)-;AC1LD7U9;2-PROPENOIC ACID, 3-(5-((4Z)-1-OXO-4-HEPTEN-2-YNYL)-2-FURANYL)-, METHYL ESTER, (2E)-;SCHEMBL2811778;CHEBI:10045;DTXSID801129316;Q27108564;methyl (E)-3-[5-[(Z)-hept-4-en-2-ynoyl]-2-furyl]prop-2-enoate

Suppliers and Price of Wyerone

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 3 raw suppliers

Chemical Property of Wyerone

Chemical Property:

Vapor Pressure:1.58E-06mmHg at 25°C
Boiling Point:397.5°Cat760mmHg
Flash Point:194.2°C
PSA：56.51000
Density:1.152g/cm³
LogP:2.61810
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:258.08920892
Heavy Atom Count:19
Complexity:447

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC=CC#CC(=O)C1=CC=C(O1)C=CC(=O)OC
Isomeric SMILES:CC/C=C\C#CC(=O)C1=CC=C(O1)/C=C/C(=O)OC

Technology Process of Wyerone

There total 5 articles about Wyerone 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: 7.0%

: 5927-18-4
trimethyl phosphonoacetate

: 148960-56-9
5-((Z)-Hept-4-en-2-ynoyl)-furan-2-carbaldehyde

: 20079-30-5
wyerone

: (Z)-3-[5-((Z)-Hept-4-en-2-ynoyl)-furan-2-yl]-acrylic acid methyl ester

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; water; at 20 ℃; for 1h;
DOI:10.1016/S0040-4039(00)60442-2

Reference yield:

: 70979-87-2
(Z)-hept-4-en-2-yn-1-ol

: 20079-30-5
wyerone

Guidance literature:: Multi-step reaction with 3 steps

1: 0.2 mg / manganese dioxide / CH₂Cl₂ / 14 h

2: 1.) lithium diisipropylamide, hexamethylphosphoramide / 1.) THF, -78 deg C, 0.5 h; 2.) -78 deg C (0.25 h) -> 15 deg C (1 h)

3: diethyl ether / 1 h / 10 °C

With N,N,N,N,N,N-hexamethylphosphoric triamide; manganese(IV) oxide; lithium diisopropyl amide; In diethyl ether; dichloromethane;

Reference yield:

: 81902-46-7
(Z)-hept-4-en-2-ynal

: 20079-30-5
wyerone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) lithium diisipropylamide, hexamethylphosphoramide / 1.) THF, -78 deg C, 0.5 h; 2.) -78 deg C (0.25 h) -> 15 deg C (1 h)

2: diethyl ether / 1 h / 10 °C

With N,N,N,N,N,N-hexamethylphosphoric triamide; lithium diisopropyl amide; In diethyl ether;