tert-Butyl 3-methyl-4-nitrobenzoate

Base Information

Chemical Name:tert-Butyl 3-methyl-4-nitrobenzoate
CAS No.:147290-67-3
Molecular Formula:C12H15 N O4
Molecular Weight:237.255
Hs Code.:
DSSTox Substance ID:DTXSID20570977
Wikidata:Q82458552
Mol file:147290-67-3.mol

Synonyms:tert-Butyl 3-methyl-4-nitrobenzoate;147290-67-3;t-butyl 3-methyl-4-nitro-benzoate;SCHEMBL1027488;Benzoic acid, 3-methyl-4-nitro-, 1,1-dimethylethyl ester;DTXSID20570977;SWAVZCKLGYSSQN-UHFFFAOYSA-N;t-butyl 3-methyl-4-nitrobenzoate;XFA29067;AKOS008988139;BS-21429;3-methyl-4-nitrobenzoic acid tert-butyl ester

Suppliers and Price of tert-Butyl 3-methyl-4-nitrobenzoate

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

Labseeker
tert-butyl3-methyl-4-nitrobenzoate 95
5g
$ 2200.00

American Custom Chemicals Corporation
TERT-BUTYL-3-METHYL-4-NITROBENZOATE 95.00%
5MG
$ 495.89

Total 3 raw suppliers

Chemical Property of tert-Butyl 3-methyl-4-nitrobenzoate

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.529
Boiling Point:345.31°C at 760 mmHg
Flash Point:142.751°C
PSA：72.12000
Density:1.157g/cm³
LogP:3.38170
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:237.10010796
Heavy Atom Count:17
Complexity:303

Purity/Quality:

98%Min ^*data from raw suppliers

tert-butyl3-methyl-4-nitrobenzoate 95 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=CC(=C1)C(=O)OC(C)(C)C)[N+](=O)[O-]

Technology Process of tert-Butyl 3-methyl-4-nitrobenzoate

There total 2 articles about tert-Butyl 3-methyl-4-nitrobenzoate 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: 97.0%