N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide

Base Information

Chemical Name:N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide
CAS No.:646029-28-9
Molecular Formula:C12H10INO
Molecular Weight:311.122
Hs Code.:
DSSTox Substance ID:DTXSID80514599
Wikidata:Q82375024

Synonyms:646029-28-9;N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide;DTXSID80514599

Suppliers and Price of N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide

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 N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:310.98071
Heavy Atom Count:15
Complexity:291

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCN(C#C)C(=O)C1=CC=CC=C1I

Technology Process of N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide

There total 3 articles about N-Ethynyl-2-iodo-N-(prop-2-en-1-yl)benzamide 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: 85.0%

: 646029-27-8
N-allyl-2-iodo-N-((trimethylsilanyl)ethynyl)benzamide

: 646029-28-9
N-allyl-N-ethynyl-2-iodo-benzamide

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 20 ℃;
DOI:10.1021/ol049302m

Reference yield:

: 66896-70-6
2-iodo-N-(2-propen-1-yl)benzamide

: 646029-28-9
N-allyl-N-ethynyl-2-iodo-benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: 63 percent / KHMDS / toluene / 24 h / 20 °C

2: 85 percent / nBu₄NF / tetrahydrofuran / 0.17 h / 0 °C

With tetrabutyl ammonium fluoride; potassium hexamethylsilazane; In tetrahydrofuran; toluene;
DOI:10.1016/j.tet.2005.11.089

Reference yield:

: 88-67-5
2-Iodobenzoic acid

: 646029-28-9
N-allyl-N-ethynyl-2-iodo-benzamide

Guidance literature:: Multi-step reaction with 3 steps

1: 73 percent / N-ethyl-N'-(3-(dimethylaminio)propyl)carbodiimide*HCl; DMAP / CH₂Cl₂; tetrahydrofuran / 12 h / 0 - 20 °C

2: 63 percent / KHMDS / toluene / 24 h / 20 °C

3: 85 percent / nBu₄NF / tetrahydrofuran / 0.17 h / 0 °C

With dmap; tetrabutyl ammonium fluoride; potassium hexamethylsilazane; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In tetrahydrofuran; dichloromethane; toluene;
DOI:10.1016/j.tet.2005.11.089