4-(Prop-1-yn-1-yl)benzaldehyde

Base Information

Chemical Name:4-(Prop-1-yn-1-yl)benzaldehyde
CAS No.:172508-29-1
Molecular Formula:C10H8 O
Molecular Weight:144.173
Hs Code.:
DSSTox Substance ID:DTXSID60479293
Nikkaji Number:J1.620.370J
Wikidata:Q82313281
Mol file:172508-29-1.mol

Synonyms:4-(prop-1-yn-1-yl)benzaldehyde;172508-29-1;4-prop-1-ynylbenzaldehyde;Benzaldehyde, 4-(1-propynyl)- (9CI);SCHEMBL15283236;DTXSID60479293;AT38439;EN300-2963948;Z1322793976

Suppliers and Price of 4-(Prop-1-yn-1-yl)benzaldehyde

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 4 raw suppliers

Chemical Property of 4-(Prop-1-yn-1-yl)benzaldehyde

Chemical Property:

PSA：17.07000
LogP:1.87050
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:144.057514874
Heavy Atom Count:11
Complexity:185

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4-(Prop-1-yn-1-yl)benzaldehyde

There total 3 articles about 4-(Prop-1-yn-1-yl)benzaldehyde 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: 97.0%

: 1122-91-4
4-bromo-benzaldehyde

: 74-99-7
prop-1-yne

: 172508-29-1
4-formyl-1-(prop-2-enyl)benzene

Guidance literature:: With copper(l) iodide; tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; triphenylphosphine; triethylamine; at 80 ℃; for 24h;
DOI:10.1021/ja0379868

Reference yield: 72.0%

: 23773-30-0
(4-bromophenyl)-1-propyne

: 68-12-2,33513-42-7
N,N-dimethyl-formamide

: 172508-29-1
4-formyl-1-(prop-2-enyl)benzene

Guidance literature:: (4-bromophenyl)-1-propyne; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 0.5h;

N,N-dimethyl-formamide; In tetrahydrofuran; diethyl ether; hexane; at -10 ℃;
DOI:10.1021/acs.joc.7b02477

Reference yield: 67.0%

: 10486-71-2
sodium propynide

: 1122-91-4
4-bromo-benzaldehyde

: 172508-29-1
4-formyl-1-(prop-2-enyl)benzene

Guidance literature:: With 9-methoxy-9-BBN; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; In tetrahydrofuran; Heating;
DOI:10.1016/0040-4020(95)00677-Z