2-Methylpropyl 1,2-oxazole-5-carboperoxoate

Base Information

Chemical Name:2-Methylpropyl 1,2-oxazole-5-carboperoxoate
CAS No.:852567-69-2
Molecular Formula:C₈H₁₁NO₄
Molecular Weight:185.18
Hs Code.:
DSSTox Substance ID:DTXSID90695500
Wikidata:Q82624710
Mol file:852567-69-2.mol

Synonyms:DTXSID90695500;2-methylpropyl 1,2-oxazole-5-carboperoxoate

Suppliers and Price of 2-Methylpropyl 1,2-oxazole-5-carboperoxoate

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

American Custom Chemicals Corporation
3-ISOPROPOXY-ISOXAZOLE-5-CARBOXYLIC ACID METHYL ESTER 95.00%
5MG
$ 495.59

Total 6 raw suppliers

Chemical Property of 2-Methylpropyl 1,2-oxazole-5-carboperoxoate

Chemical Property:

Boiling Point:279.8±20.0 °C(Predicted)
PKA:-4.80±0.50(Predicted)
Density:1.152±0.06 g/cm3(Predicted)
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:185.06880783
Heavy Atom Count:13
Complexity:172

Purity/Quality:

99% ^*data from raw suppliers

3-ISOPROPOXY-ISOXAZOLE-5-CARBOXYLIC ACID METHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)COOC(=O)C1=CC=NO1

Technology Process of 2-Methylpropyl 1,2-oxazole-5-carboperoxoate

There total 2 articles about 2-Methylpropyl 1,2-oxazole-5-carboperoxoate 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: 91.0%

: 67-63-0,8013-70-5
isopropyl alcohol

: 10068-07-2
methyl 3-hydroxy-5-isoxazolecarboxylate

: 852567-69-2
methyl 3-isopropoxyisoxazole-5-carboxylate

: C₈H₁₁NO₅

Guidance literature:: isopropyl alcohol; methyl 3-hydroxy-5-isoxazolecarboxylate; With triphenylphosphine; In chloroform; at 20 ℃; for 0.0333333h;

With di-isopropyl azodicarboxylate; In chloroform; at 20 ℃; for 0.25h; Solvent; regioselective reaction; Inert atmosphere;
DOI:10.1016/j.tetlet.2014.01.065

Reference yield: 88.0%

: 75-26-3
isopropyl bromide

: 10068-07-2
methyl 3-hydroxy-5-isoxazolecarboxylate

: 852567-69-2
methyl 3-isopropoxyisoxazole-5-carboxylate

Guidance literature:: methyl 3-hydroxy-5-isoxazolecarboxylate; With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 1h; Inert atmosphere;

isopropyl bromide; In N,N-dimethyl-formamide; at 55 ℃; Inert atmosphere;
DOI:10.1021/jm301473k