4-Heptanone, 5-ethyl-1-(2-iodophenyl)-

Base Information

Chemical Name:4-Heptanone, 5-ethyl-1-(2-iodophenyl)-
CAS No.:872835-39-7
Molecular Formula:C15H21IO
Molecular Weight:344.236
Hs Code.:
DSSTox Substance ID:DTXSID60467791
Wikidata:Q82294861

Synonyms:4-Heptanone, 5-ethyl-1-(2-iodophenyl)-;872835-39-7;SCHEMBL6072610;DTXSID60467791

Suppliers and Price of 4-Heptanone, 5-ethyl-1-(2-iodophenyl)-

Supply Marketing:

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

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Chemical Property of 4-Heptanone, 5-ethyl-1-(2-iodophenyl)-

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:344.06371
Heavy Atom Count:17
Complexity:223

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(CC)C(=O)CCCC1=CC=CC=C1I

Technology Process of 4-Heptanone, 5-ethyl-1-(2-iodophenyl)-

There total 2 articles about 4-Heptanone, 5-ethyl-1-(2-iodophenyl)- 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:

: 123184-16-7
4-ethyl-1-hexen-3-one

: 117269-71-3
(2-iodobenzyl)zinc bromide

: 872835-39-7
5-ethyl-1-(2-iodophenyl)-4-heptanone

Guidance literature:: (2-iodobenzyl)zinc bromide; With lithium chloride; In tetrahydrofuran; at 0 ℃; for 0.333333h;

4-ethyl-1-hexen-3-one; With chloro-trimethyl-silane; In tetrahydrofuran; at -75 - 20 ℃; for 4.5h;
DOI:10.1021/jm060302x

Reference yield:

: 308796-09-0
1-ethylpropylzinc bromide

: 872835-39-7
5-ethyl-1-(2-iodophenyl)-4-heptanone

Guidance literature:: Multi-step reaction with 2 steps

1.1: Pd(PPh₃)4 / tetrahydrofuran / 1.5 h / 0 °C

2.1: LiCl; CuCN / tetrahydrofuran / 0.33 h / 0 °C

2.2: 3.12 g / Me₃SiCl / tetrahydrofuran / 4.5 h / -75 - 20 °C

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; lithium chloride; In tetrahydrofuran;
DOI:10.1021/jm060302x

Reference yield: 76.0%

: 872835-39-7
5-ethyl-1-(2-iodophenyl)-4-heptanone

: 1779-49-3
Methyltriphenylphosphonium bromide

: 872835-40-0
1-[4-(1-ethylpropyl)-4-penten-1-yl]-2-iodobenzene

Guidance literature:: Methyltriphenylphosphonium bromide; With n-butyllithium; In tetrahydrofuran; hexane; at 0 ℃; for 0.5h;

5-ethyl-1-(2-iodophenyl)-4-heptanone; In tetrahydrofuran; hexane; at 20 ℃; for 1h;
DOI:10.1021/jm060302x