5-(Bromomethyl)isoxazole-3-carboxylic acid

Base Information

Chemical Name:5-(Bromomethyl)isoxazole-3-carboxylic acid
CAS No.:95312-11-1
Molecular Formula:C5H4BrNO3
Molecular Weight:205.99400
Hs Code.:
DSSTox Substance ID:DTXSID50538545
Wikidata:Q82413976
Mol file:95312-11-1.mol

Synonyms:5-(Bromomethyl)isoxazole-3-carboxylic acid;95312-11-1;5-(Bromomethyl)-1,2-oxazole-3-carboxylic acid;SCHEMBL1805432;DTXSID50538545;NLVFKSGKVJTKSU-UHFFFAOYSA-N;5-Bromomethyl-3-isoxazolecarboxylic acid

Suppliers and Price of 5-(Bromomethyl)isoxazole-3-carboxylic 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

American Custom Chemicals Corporation
5-(BROMOMETHYL)-3-ISOXAZOLECARBOXYLIC ACID 95.00%
5MG
$ 502.90

Total 3 raw suppliers

Chemical Property of 5-(Bromomethyl)isoxazole-3-carboxylic acid

Chemical Property:

PSA：63.33000
LogP:1.26770
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:204.93746
Heavy Atom Count:10
Complexity:141

Purity/Quality:: 5-(BROMOMETHYL)-3-ISOXAZOLECARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=C(ON=C1C(=O)O)CBr

Technology Process of 5-(Bromomethyl)isoxazole-3-carboxylic acid

There total 6 articles about 5-(Bromomethyl)isoxazole-3-carboxylic 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:

: 84654-29-5
5-(bromomethyl)-3-isoxazolecarboxylic acid ethyl ester

: 95312-11-1
5-(bromomethyl)-3-isoxazolecarboxylic acid

Guidance literature:: With lithium hydrochloride monohydrate; In tetrahydrofuran; water; at 20 ℃; for 3.5h;
DOI:10.1021/jm100556b

Reference yield:

: 95312-27-9
methyl-5-(bromomethyl)isoxazole-3-carboxylate

: 95312-11-1
5-(bromomethyl)-3-isoxazolecarboxylic acid

Guidance literature:: methyl-5-(bromomethyl)isoxazole-3-carboxylate; With lithium hydroxide; water; In tetrahydrofuran; at 0 - 20 ℃;

With hydrogenchloride; In tetrahydrofuran; water; pH=1;