3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde

Base Information

Chemical Name:3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde
CAS No.:107356-11-6
Molecular Formula:C₁₇H₂₀ClNO₃
Molecular Weight:321.804
Hs Code.:
DSSTox Substance ID:DTXSID901154950

Synonyms:SCHEMBL9706272;DTXSID901154950;3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde;107356-11-6

Suppliers and Price of 3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde

Supply Marketing:

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

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Chemical Property of 3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:321.1131712
Heavy Atom Count:22
Complexity:342

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=CC(=C1OCCCCCC2=CC(=NO2)C)Cl)C=O

Technology Process of 3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]benzaldehyde

There total 2 articles about 3-Chloro-5-methyl-4-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]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: 83.0%

: 107356-10-5
3-Chloro-4-hydroxy-5-methylbenzaldehyde

: 98033-85-3
5-(5-bromopentyl)-3-methylisoxazole

: 107356-11-6
3-Chloro-5-methyl-4-<<5-(3-methyl-5-isoxazolyl)pentyl>oxy>benzaldehyde

Guidance literature:: With potassium carbonate; sodium iodide; In N,N-dimethyl-formamide; at 100 ℃; for 1.5h;
DOI:10.1021/jm00122a027

Reference yield:

: 87-64-9
2-chloro-6-methylphenol

: 107356-11-6
3-Chloro-5-methyl-4-<<5-(3-methyl-5-isoxazolyl)pentyl>oxy>benzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 62 percent / trifluoroacetic acid / Heating

2: 83 percent / K₂CO₃, NaI / dimethylformamide / 1.5 h / 100 °C

With potassium carbonate; trifluoroacetic acid; sodium iodide; In N,N-dimethyl-formamide;
DOI:10.1021/jm00122a027