Benzaldehyde, 2-(1-pentynyl)-

Base Information

Chemical Name:Benzaldehyde, 2-(1-pentynyl)-
CAS No.:571184-11-7
Molecular Formula:C12H12O
Molecular Weight:172.227
Hs Code.:
DSSTox Substance ID:DTXSID70472634
Nikkaji Number:J2.077.205K
Wikidata:Q82301645

Synonyms:Benzaldehyde, 2-(1-pentynyl)-;571184-11-7;DTXSID70472634

Suppliers and Price of Benzaldehyde, 2-(1-pentynyl)-

Supply Marketing:

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

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Chemical Property of Benzaldehyde, 2-(1-pentynyl)-

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:172.088815002
Heavy Atom Count:13
Complexity:218

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC#CC1=CC=CC=C1C=O

Technology Process of Benzaldehyde, 2-(1-pentynyl)-

There total 2 articles about Benzaldehyde, 2-(1-pentynyl)- 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: 98.0%

: 627-19-0
1-Pentyne

: 6630-33-7
ortho-bromobenzaldehyde

: 571184-11-7
2-pent-1-ynyl-benzaldehyde

Guidance literature:: 1-Pentyne; ortho-bromobenzaldehyde; With trans-bis(triphenylphosphine)palladium dichloride; triethylamine; at 20 ℃; for 0.166667h; Inert atmosphere;

With copper(l) iodide; at 50 ℃; for 5h; Inert atmosphere;
DOI:10.1002/ejoc.201601602

Reference yield:

: 627-19-0
1-Pentyne

: 26260-02-6
2-iodobenzaldehyde

: 571184-11-7
2-pent-1-ynyl-benzaldehyde

Guidance literature:: 2-iodobenzaldehyde; With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 23 - 25 ℃; for 0.25h; Inert atmosphere;

1-Pentyne; at 50 ℃; for 4h; Inert atmosphere;
DOI:10.1021/ol300457c

Reference yield: 96.0%

: 536-74-3
phenylacetylene

: 571184-11-7
2-pent-1-ynyl-benzaldehyde

: 1370697-41-8
1-(2-(pent-1-yn-1-yl)phenyl)-3-phenylprop-2-yn-1-ol

Guidance literature:: phenylacetylene; With n-butyllithium; In tetrahydrofuran; at -78 ℃; for 0.166667h;

2-pent-1-ynyl-benzaldehyde; In tetrahydrofuran; at -78 - 20 ℃; for 3h;
DOI:10.1002/chem.201502370