Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)-

Base Information

Chemical Name:Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)-
CAS No.:919109-49-2
Molecular Formula:C16H24N2O2
Molecular Weight:276.379
Hs Code.:
DSSTox Substance ID:DTXSID20479335
Nikkaji Number:J2.391.773D
Wikidata:Q82313329

Synonyms:919109-49-2;Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)-;DTXSID20479335

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Supply Marketing:

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

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Chemical Property of Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)-

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:276.183778013
Heavy Atom Count:20
Complexity:321

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC(=C(C(=C1)C=O)O)CN2CCNCC2

Technology Process of Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)-

There total 7 articles about Benzaldehyde, 5-(1,1-dimethylethyl)-2-hydroxy-3-(1-piperazinylmethyl)- 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%

: 905441-90-9
4-(5-tert-butyl-3-formyl-2-hydroxy-benzyl)-piperazine-1-carboxylic acid tert-butyl ester

: 919109-49-2
5-(tert-butyl)-2-hydroxy-3-(piperazin-1-ylmethyl)benzaldehyde

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 20h;
DOI:10.1016/j.tet.2005.03.117

Reference yield: 83.0%

: 919109-51-6
5-tert-butyl-2-hydroxy-3-(N'-acylpiperazinomethyl)benzaldehyde

: 919109-49-2
5-(tert-butyl)-2-hydroxy-3-(piperazin-1-ylmethyl)benzaldehyde

Guidance literature:: With hydrogenchloride; at 100 ℃; for 96h;
DOI:10.1016/j.tetlet.2006.09.149

Reference yield:

: 2725-53-3
2-hydroxy-5-t-butylbenzaldehyde

: 919109-49-2
5-(tert-butyl)-2-hydroxy-3-(piperazin-1-ylmethyl)benzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 98 percent / HBr; H₂SO₄; water / 20 h / 70 °C

2: Et₃N / CH₂Cl₂ / 20 °C

With sulfuric acid; water; hydrogen bromide; triethylamine; In dichloromethane;
DOI:10.1016/j.tetlet.2006.09.149