Isopropyl 3-bromo-2-oxopropanoate

Base Information

Chemical Name:Isopropyl 3-bromo-2-oxopropanoate
CAS No.:56417-63-1
Molecular Formula:C6H9BrO3
Molecular Weight:209.04
Hs Code.:
DSSTox Substance ID:DTXSID30604176
Wikidata:Q82501965
Mol file:56417-63-1.mol

Synonyms:isopropyl 3-bromo-2-oxopropanoate;56417-63-1;ISOPROPYL BROMOPYRUVATE;Propan-2-yl 3-bromo-2-oxopropanoate;Propanoic acid, 3-bromo-2-oxo-, 1-methylethyl ester;isopropyl3-bromo-2-oxopropanoate;iso-propyl 3-bromopyruvate;SCHEMBL1242991;DTXSID30604176;MBTUZNKTKYBZQY-UHFFFAOYSA-N;CS-M0667;AKOS028114239;CS-16993;DB-370617

Suppliers and Price of Isopropyl 3-bromo-2-oxopropanoate

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

TRC
Isopropyl3-Bromo-2-oxopropanoate
50mg
$ 45.00

ChemScene
isopropyl3-bromo-2-oxopropanoate
250mg
$ 63.00

Total 7 raw suppliers

Chemical Property of Isopropyl 3-bromo-2-oxopropanoate

Chemical Property:

Boiling Point:213.0±23.0 °C(Predicted)
Density:1.474±0.06 g/cm3(Predicted)
XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:207.97351
Heavy Atom Count:10
Complexity:142

Purity/Quality:

≥95% ^*data from raw suppliers

Isopropyl3-Bromo-2-oxopropanoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)OC(=O)C(=O)CBr

Technology Process of Isopropyl 3-bromo-2-oxopropanoate

There total 1 articles about Isopropyl 3-bromo-2-oxopropanoate 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:

: 1113-59-3
bromopyruvic acid

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

: 56417-63-1
iso-propyl 3-bromo-2-oxopropanoate

: 942148-14-3
isopropyl 3-chloro-2-oxopropionate

Guidance literature:: With thionyl chloride; at 0 - 20 ℃; for 3.5h;

Reference yield: 78.0%

: 56417-63-1
iso-propyl 3-bromo-2-oxopropanoate

: 603-35-0
triphenylphosphine

: iso-propyl 2-oxo-3-(triphenyl-λ5-phosphaneylidene)propanoate

Guidance literature:: iso-propyl 3-bromo-2-oxopropanoate; triphenylphosphine; In tetrahydrofuran; at 60 ℃; for 2h; Inert atmosphere;

With potassium hydroxide; In dichloromethane; water; at 20 ℃; for 0.5h; Inert atmosphere;
DOI:10.1002/adsc.202100785

Reference yield: 61.2%

: 56417-63-1
iso-propyl 3-bromo-2-oxopropanoate

: 2-(5-benzyl-5,7a-dihydro-1H-pyrrolo[3,2-c]pyridin-3-yl)-2-methylpropan-1-amine

: isopropyl 2-benzyl-10,10-dimethyl-2,8,9,10-tetrahydropyrido[3',4':4,5]pyrrolo[2,3-d]azepine-6-carboxylate

Guidance literature:: 2-(5-benzyl-5,7a-dihydro-1H-pyrrolo[3,2-c]pyridin-3-yl)-2-methylpropan-1-amine; With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 0.5h; Inert atmosphere;

iso-propyl 3-bromo-2-oxopropanoate; In isopropyl alcohol; at 80 ℃; for 5h;

With pyridine; at 100 ℃; for 3h;