Tert-butyl 2-nitropropanoate

Base Information

Chemical Name:Tert-butyl 2-nitropropanoate
CAS No.:18598-92-0
Molecular Formula:C7H13NO4
Molecular Weight:175.185
Hs Code.:
DSSTox Substance ID:DTXSID70456530
Nikkaji Number:J795.696G

Synonyms:Tert-butyl 2-nitropropanoate;18598-92-0;2-Nitropropanoic acid tert-butyl ester;Propanoic acid, 2-nitro-, 1,1-dimethylethyl ester;DTXSID70456530;F87685

Suppliers and Price of Tert-butyl 2-nitropropanoate

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

Total 7 raw suppliers

Chemical Property of Tert-butyl 2-nitropropanoate

Chemical Property:

XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:175.08445790
Heavy Atom Count:12
Complexity:189

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C(=O)OC(C)(C)C)[N+](=O)[O-]

Technology Process of Tert-butyl 2-nitropropanoate

There total 2 articles about Tert-butyl 2-nitropropanoate 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: 28.0%

: 39149-80-9,54631-38-8,98104-35-9,32821-07-1
tert-butyl 2-bromopropionate

: 18598-92-0
2-nitropropanoic acid tert-butyl ester

Guidance literature:: With 3,5-dihydroxyphenol; sodium nitrite; In N,N-dimethyl-formamide; for 2h;
DOI:10.1016/j.tetlet.2007.01.073

Reference yield:

: 20487-40-5
tert-butyl propionate

: 18598-92-0
2-nitropropanoic acid tert-butyl ester

Guidance literature:: Multistep reaction; (i) KNH₂, liq. NH₃, EtONO₂, Et₂O, (ii) AcOH;
DOI:10.1021/jo01256a048

Reference yield: 99.0%

: 18598-92-0
2-nitropropanoic acid tert-butyl ester

: 85217-69-2,87802-71-9
cinnamyl methyl carbonate

: C₁₆H₂₁NO₄

Guidance literature:: With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; C₁₀H₁₆N⁽¹⁺⁾*C₄₀H₂₅O₂^(1-); triphenylphosphine; In toluene; at 20 ℃; for 5h;
DOI:10.1038/nchem.1311