Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate

Base Information

Chemical Name:Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate
CAS No.:130872-29-6
Molecular Formula:C₁₇H₂₅NO₄
Molecular Weight:307.39
Hs Code.:
DSSTox Substance ID:DTXSID601181805

Synonyms:Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate;130872-29-6;SCHEMBL9368903;KOPBXQLEBMSYPB-UHFFFAOYSA-N;DTXSID601181805;Ethyl 4-(1,1-dimethylethyl)-I(2)-(1-nitroethyl)benzenepropanoate

Suppliers and Price of Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate

Chemical Property:

XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:307.17835828
Heavy Atom Count:22
Complexity:375

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)CC(C1=CC=C(C=C1)C(C)(C)C)C(C)[N+](=O)[O-]

Technology Process of Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate

There total 3 articles about Ethyl 4-nitro-3-(4-t-butylphenyl)pentanoate 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:

: 939-97-9
4-tert-Butylbenzaldehyde

: 130872-29-6
Ethyl 4-nitro-3-(4-tert-butylphenyl)pentanoate

Guidance literature:: Multi-step reaction with 2 steps

1.1: NaH / tetrahydrofuran / 0.5 h / 0 °C

1.2: tetrahydrofuran / 0 - 20 °C

2.1: Bu₄NF / methanol / 3 h / Heating

With tetrabutyl ammonium fluoride; sodium hydride; In tetrahydrofuran; methanol; 1.1: Metallation / 1.2: Condensation / 2.1: Addition;
DOI:10.1002/(SICI)1096-9063(199707)50:3<258::AID-PS587>3.0.CO;2-3

Reference yield:

: 79-24-3
Nitroethane

: 158010-17-4
ethyl (E)-3-[4-(tert-butylphenyl)]-2-propenoate

: 130872-29-6
Ethyl 4-nitro-3-(4-tert-butylphenyl)pentanoate

Guidance literature:: With tetrabutyl ammonium fluoride; In methanol; for 3h; Heating;
DOI:10.1002/(SICI)1096-9063(199707)50:3<258::AID-PS587>3.0.CO;2-3