5-Benzyl-4-isoxazolecarboxylic acid

Base Information

Chemical Name:5-Benzyl-4-isoxazolecarboxylic acid
CAS No.:134541-07-4
Molecular Formula:C₁₁H₉NO₃
Molecular Weight:203.197
Hs Code.:
DSSTox Substance ID:DTXSID501262719
Nikkaji Number:J396.798K

Synonyms:5-Benzyl-4-isoxazolecarboxylic acid;134541-07-4;5-benzyl-1,2-oxazole-4-carboxylic acid;5-benzylisoxazole-4-carboxylic acid;SCHEMBL3547750;PSPHDNPKCYJGGF-UHFFFAOYSA-N;DTXSID501262719;5-(Phenylmethyl)-4-isoxazolecarboxylic acid;EN300-1863753

Suppliers and Price of 5-Benzyl-4-isoxazolecarboxylic acid

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

AK Scientific
5-Benzyl-4-isoxazolecarboxylicacid
5g
$ 2894.00

AK Scientific
5-Benzyl-4-isoxazolecarboxylicacid
250mg
$ 576.00

Total 0 raw suppliers

Chemical Property of 5-Benzyl-4-isoxazolecarboxylic acid

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:203.058243149
Heavy Atom Count:15
Complexity:226

Purity/Quality:: 5-Benzyl-4-isoxazolecarboxylicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)CC2=C(C=NO2)C(=O)O

Technology Process of 5-Benzyl-4-isoxazolecarboxylic acid

There total 2 articles about 5-Benzyl-4-isoxazolecarboxylic acid 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: 74.0%

: 134540-98-0
5-Benzyl-isoxazole-4-carboxylic acid methyl ester

: 134541-07-4
5-Benzyl-4-isoxazolecarboxylic acid

Guidance literature:: With hydrogenchloride; acetic acid; for 8h; Heating;

Reference yield:

: 116344-11-7
2-[1-Dimethylamino-meth-(E)-ylidene]-3-oxo-4-phenyl-butyric acid methyl ester

: 134541-07-4
5-Benzyl-4-isoxazolecarboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 74 percent / NH₂OH*HCl / methanol / 1 h / Heating

2: 74 percent / conc.HCl, AcOH / 8 h / Heating

With hydrogenchloride; hydroxylamine hydrochloride; acetic acid; In methanol;