2-Heptanone, 1-(2-pyridinyl)-

Base Information

Chemical Name:2-Heptanone, 1-(2-pyridinyl)-
CAS No.:21211-98-3
Molecular Formula:C12H17NO
Molecular Weight:191.273
Hs Code.:
DSSTox Substance ID:DTXSID00388658
Mol file:21211-98-3.mol

Synonyms:1-(2-Pyridyl)-2-heptanone;NIOSH/MJ7680000;2-Heptanone, 1-(2-pyridyl)-;MJ76800000;2-Heptanone, 1-(2-pyridinyl)-;21211-98-3;SCHEMBL6911822;DTXSID00388658;LS-74520

Suppliers and Price of 2-Heptanone, 1-(2-pyridinyl)-

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 0 raw suppliers

Chemical Property of 2-Heptanone, 1-(2-pyridinyl)-

Chemical Property:

Vapor Pressure:0.00318mmHg at 25°C
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:191.131014166
Heavy Atom Count:14
Complexity:168

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(=O)CC1=CC=CC=N1

Technology Process of 2-Heptanone, 1-(2-pyridinyl)-

There total 3 articles about 2-Heptanone, 1-(2-pyridinyl)- 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: 79.0%

: 49836-16-0
2-(hept-1-yn-1-yl)pyridine

: 104-94-9
4-methoxy-aniline

: 21211-98-3
1-(pyridin-2-yl)heptan-2-one

: (Z)-4-methoxy-N-(1-(pyridin-2-yl)hept-1-en-2-yl)aniline

Guidance literature:: With Echavarren's catalyst; In dichloromethane; at 80 ℃; for 48h; stereoselective reaction;
DOI:10.1039/c8ob02356e

Reference yield:

: 109-04-6
2-bromo-pyridine

: 21211-98-3
1-(pyridin-2-yl)heptan-2-one

: (Z)-4-methoxy-N-(1-(pyridin-2-yl)hept-1-en-2-yl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1: bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 1 h / 20 °C / Inert atmosphere

2: Echavarren's catalyst / dichloromethane / 48 h / 80 °C

With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; Echavarren's catalyst; N-ethyl-N,N-diisopropylamine; In dichloromethane; N,N-dimethyl-formamide; 1: |Sonogashira Cross-Coupling;
DOI:10.1039/c8ob02356e

Reference yield:

: 628-71-7
1-Heptyne

: 21211-98-3
1-(pyridin-2-yl)heptan-2-one

: (Z)-4-methoxy-N-(1-(pyridin-2-yl)hept-1-en-2-yl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1: bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 1 h / 20 °C / Inert atmosphere

2: Echavarren's catalyst / dichloromethane / 48 h / 80 °C

With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; Echavarren's catalyst; N-ethyl-N,N-diisopropylamine; In dichloromethane; N,N-dimethyl-formamide; 1: |Sonogashira Cross-Coupling;
DOI:10.1039/c8ob02356e