1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

Base Information

Chemical Name:1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone
CAS No.:164082-78-4
Molecular Formula:C16H23NO4
Molecular Weight:293.363
Hs Code.:
DSSTox Substance ID:DTXSID601190408
Mol file:164082-78-4.mol

Synonyms:1-[2-(tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone;164082-78-4;SCHEMBL26208;Tert-butyl N-[3-methoxy-2-(2-oxobutyl)phenyl]carbamate;WWRURGHCIPXMFN-UHFFFAOYSA-N;DTXSID601190408;1- [2- (tert-butoxycarbonylamino) -6-methoxyphenyl]-2-butanone;Carbamic acid,[3-methoxy-2-(2-oxobutyl)phenyl]-,1,1-dimethylethyl ester (9CI)

Suppliers and Price of 1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

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

American Custom Chemicals Corporation
TERT-BUTYL-3-METHOXY-2-(2-OXOBUTYL)PHENYLCARBAMATE 95.00%
5MG
$ 500.37

Total 1 raw suppliers

Chemical Property of 1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

Chemical Property:

PSA：64.63000
LogP:3.63680
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:293.16270821
Heavy Atom Count:21
Complexity:362

Purity/Quality:: TERT-BUTYL-3-METHOXY-2-(2-OXOBUTYL)PHENYLCARBAMATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=O)CC1=C(C=CC=C1OC)NC(=O)OC(C)(C)C

Technology Process of 1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

There total 4 articles about 1-[2-(Tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone 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:

N-methyl-N-methoxypropionamide: 104863-65-2
N-methyl-N-methoxypropionamide

: 164082-77-3
tert-butyl (3-methoxy-2-methylphenyl)carbamate

: 164082-78-4
1-[2-(tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

Guidance literature:: With sec.-butyllithium; Multistep reaction; 1.) cyclohexanone, THF, -40 deg C, 0.25 h, 2.) cyclohexanone, THF, from -40 deg C to RT, 2 h;
DOI:10.1021/jm960485v

Reference yield:

: 24424-99-5
di-tert-butyl dicarbonate

: 164082-78-4
1-[2-(tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

Guidance literature:: Multi-step reaction with 2 steps

1: 73 percent / tetrahydrofuran / 2 h / Heating

2: 1.) s-BuLi / 1.) cyclohexanone, THF, -40 deg C, 0.25 h, 2.) cyclohexanone, THF, from -40 deg C to RT, 2 h

With sec.-butyllithium; In tetrahydrofuran;
DOI:10.1021/jm960485v

Reference yield:

: 19500-02-8
2-methyl-3-methoxyaniline

: 164082-78-4
1-[2-(tert-butoxycarbonylamino)-6-methoxyphenyl]-2-butanone

Guidance literature:: Multi-step reaction with 2 steps

1: 73 percent / tetrahydrofuran / 2 h / Heating

2: 1.) s-BuLi / 1.) cyclohexanone, THF, -40 deg C, 0.25 h, 2.) cyclohexanone, THF, from -40 deg C to RT, 2 h

With sec.-butyllithium; In tetrahydrofuran;
DOI:10.1021/jm960485v