3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-

Base Information

Chemical Name:3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-
CAS No.:127404-75-5
Molecular Formula:C₁₀H₈F₂O₂
Molecular Weight:198.169
Hs Code.:
DSSTox Substance ID:DTXSID901246585

Synonyms:3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-;SCHEMBL5309876;DTXSID901246585;127404-75-5

Suppliers and Price of 3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:198.04923582
Heavy Atom Count:14
Complexity:228

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=C(C=C1C=CCC(=O)O)F)F
Isomeric SMILES:C1=CC(=C(C=C1/C=C/CC(=O)O)F)F

Technology Process of 3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)-

There total 2 articles about 3-Butenoic acid, 4-(3,4-difluorophenyl)-, (E)- 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: 46.0%

: 127404-75-5
4-(3,4-difluorophenyl)-3-butenoic acid

Guidance literature:

Reference yield:

: 1117-71-1
methyl 4-bromocrotonate

: 136294-91-2
tributyl(3,4-difluorophenyl)stannane

: 127404-75-5
4-(3,4-difluorophenyl)-3-butenoic acid

: 136294-97-8
(E)-4-(3,4-Difluoro-phenyl)-but-2-enoic acid

Guidance literature:: With lithium hydroxide; bis(triphenylphosphine)palladium(II)-chloride; diisobutylaluminium hydride; Multistep reaction. Title compound not separated from byproducts; 1.) THF, toluene, reflux, 15 h, 2.) THF, H₂O, reflux, 6 h;
DOI:10.1080/00397919108019786