Propan-2-yl 2-oxo-4-phenylbut-3-enoate

Base Information

Chemical Name:Propan-2-yl 2-oxo-4-phenylbut-3-enoate
CAS No.:111160-44-2
Molecular Formula:C13H14O3
Molecular Weight:218.252
Hs Code.:
DSSTox Substance ID:DTXSID80709761
Mol file:111160-44-2.mol

Synonyms:Propan-2-yl 2-oxo-4-phenylbut-3-enoate;111160-44-2;DTXSID80709761

Suppliers and Price of Propan-2-yl 2-oxo-4-phenylbut-3-enoate

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 Propan-2-yl 2-oxo-4-phenylbut-3-enoate

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:218.094294304
Heavy Atom Count:16
Complexity:273

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)OC(=O)C(=O)C=CC1=CC=CC=C1

Technology Process of Propan-2-yl 2-oxo-4-phenylbut-3-enoate

There total 3 articles about Propan-2-yl 2-oxo-4-phenylbut-3-enoate 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:

: 201230-82-2
carbon monoxide

: 101349-79-5
2-phenylvinyl iodide

: 67-63-0,8013-70-5
isopropyl alcohol

: 7780-06-5
isopropyl cinnamate

: 111160-44-2
i-propyl 2-oxo-4-phenylbut-3-enoate

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; triethylamine; for 94h; under 114000 Torr; Ambient temperature;
DOI:10.1021/jo00235a017

Reference yield:

: 100-52-7
benzaldehyde

: 111160-44-2
i-propyl 2-oxo-4-phenylbut-3-enoate

Guidance literature:: Multi-step reaction with 2 steps

1: potassium hydroxide / methanol / 13 h / 10 - 40 °C / Inert atmosphere

2: acetyl chloride / 8 h / 0 - 20 °C / Reflux; Inert atmosphere

With acetyl chloride; potassium hydroxide; In methanol;
DOI:10.1002/anie.201107324