N-tert-Butyl-4-nitrobenzamide

Base Information

Chemical Name:N-tert-Butyl-4-nitrobenzamide
CAS No.:42498-30-6
Molecular Formula:C11H14N2O3
Molecular Weight:222.244
Hs Code.:
European Community (EC) Number:820-569-6
DSSTox Substance ID:DTXSID901308212
Nikkaji Number:J144.457C
Mol file:42498-30-6.mol

Synonyms:N-tert-Butyl-4-nitrobenzamide;N-tert-Butyl-4-nitro-benzamide;42498-30-6;N-(tert-butyl)-4-nitrobenzamide;Benzamide, N-(1,1-dimethylethyl)-4-nitro-;N-t-butyl-4-nitrobenzamide;Oprea1_572674;N-t -butyl-4-nitrobenzamide;N-tert-butyl 4-nitrobenzamide;N-tert-Butyl-p-nitrobenzamide;N-(t-butyl)-4-nitrobenzamide;SCHEMBL1857541;DTXSID901308212;N-(tert-butyl)-4-nitro benzamide;STK948938;AKOS000502715;BS-46188;CS-0160416;E74449;Z54128376

Suppliers and Price of N-tert-Butyl-4-nitrobenzamide

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

Aronis compounds
N-(tert-butyl)-4-nitrobenzamide
1mg
$ 12.00

Aronis compounds
N-(tert-butyl)-4-nitrobenzamide
10mg
$ 20.00

American Custom Chemicals Corporation
N-TERT-BUTYL-4-NITRO-BENZAMIDE 95.00%
5MG
$ 498.16

Ambeed
N-tert-Butyl-4-nitro-benzamide 95%
100g
$ 134.00

Ambeed
N-tert-Butyl-4-nitro-benzamide 95%
25g
$ 37.00

Ambeed
N-tert-Butyl-4-nitro-benzamide 95%
5g
$ 13.00

Total 6 raw suppliers

Chemical Property of N-tert-Butyl-4-nitrobenzamide

Chemical Property:

Melting Point:160.96 °C
Boiling Point:390.0±25.0 °C(Predicted)
PKA:13.63±0.46(Predicted)
PSA：74.92000
Density:1.162±0.06 g/cm3(Predicted)
LogP:3.03720
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:222.10044231
Heavy Atom Count:16
Complexity:270

Purity/Quality:

99.9% ^*data from raw suppliers

N-(tert-butyl)-4-nitrobenzamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of N-tert-Butyl-4-nitrobenzamide

There total 37 articles about N-tert-Butyl-4-nitrobenzamide 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: 99.0%

: 75-64-9
tert-butylamine

: 62-23-7
4-nitro-benzoic acid

: 42498-30-6
N-tert-butyl-4-nitrobenzamide

Guidance literature:: With (3-{[(cyclohexylimino)methylidene]amino}propyl)oxy linked polystyrene resin; In dichloromethane; N,N-dimethyl-formamide; for 0.0833333h; Flow reactor;
DOI:10.1021/acscombsci.0c00001

Reference yield: 98.0%

: 26378-36-9,39245-61-9,39245-62-0,59905-68-9
(3S)-trans-2-tert-butyl-3-(4-nitro-phenyl)-oxaziridine

: 42498-30-6
N-tert-butyl-4-nitrobenzamide

Guidance literature:: With iron(III) sulfate pentahydrate; sodium dodecyl-sulfate; In water; at 20 - 70 ℃; for 1h; Green chemistry;
DOI:10.1039/c6gc03589b

Reference yield: 95.0%

: 555-16-8
4-nitrobenzaldehdye

: 75-65-0
tert-butyl alcohol

: 42498-30-6
N-tert-butyl-4-nitrobenzamide

Guidance literature:: 4-nitrobenzaldehdye; With sodium azide; trifluorormethanesulfonic acid; acetic acid; at 40 ℃; for 2h;

tert-butyl alcohol; With trifluorormethanesulfonic acid; at 40 ℃; for 2h;
DOI:10.1016/j.tetlet.2016.08.069