Tert-butyl 3-aminobenzyl(methyl)carbamate

Base Information

Chemical Name:Tert-butyl 3-aminobenzyl(methyl)carbamate
CAS No.:167756-90-3
Molecular Formula:C13H20N2O2
Molecular Weight:236.314
Hs Code.:
European Community (EC) Number:828-434-3
Mol file:167756-90-3.mol

Synonyms:tert-butyl 3-aminobenzyl(methyl)carbamate;167756-90-3;tert-butyl N-[(3-aminophenyl)methyl]-N-methylcarbamate;SCHEMBL2228851;AMY27740;AKOS009304735;CS-0247714;EN300-37241;E82561;J-010392;Z381072288

Suppliers and Price of Tert-butyl 3-aminobenzyl(methyl)carbamate

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

AK Scientific
Tert-butyl3-aminobenzyl(methyl)carbamate
5g
$ 1269.00

Abosyn
tert-butyl3-aminobenzyl(methyl)carbamate 95%-98%
1g
$ 690.00

Total 7 raw suppliers

Chemical Property of Tert-butyl 3-aminobenzyl(methyl)carbamate

Chemical Property:

Boiling Point:363.1±21.0 °C(Predicted)
PSA：55.56000
Density:1.084±0.06 g/cm3(Predicted)
LogP:3.21690
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:236.152477885
Heavy Atom Count:17
Complexity:261

Purity/Quality:

98% ^*data from raw suppliers

Tert-butyl3-aminobenzyl(methyl)carbamate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N(C)CC1=CC(=CC=C1)N

Technology Process of Tert-butyl 3-aminobenzyl(methyl)carbamate

There total 8 articles about Tert-butyl 3-aminobenzyl(methyl)carbamate 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: 100.0%

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

: 19499-61-7
methyl-(3-nitro-benzyl)-amine

: 167756-90-3
tert-butyl N-[(3-aminophenyl)methyl]-N-methylcarbamate

Guidance literature:: di-tert-butyl dicarbonate; methyl-(3-nitro-benzyl)-amine; In acetonitrile; at 20 ℃; for 12h;

With hydrazine; palladium 10% on activated carbon; In ethanol; at 20 ℃; for 0.5h;

Reference yield: 89.0%

: 180002-02-2
tert-butyl methyl(3-nitrobenzyl)carbamate

: 167756-90-3
tert-butyl N-[(3-aminophenyl)methyl]-N-methylcarbamate

Guidance literature:: With sodiumsulfide nonahydrate; sodium hydroxide; In methanol; water; for 1h; Reflux;
DOI:10.1021/acs.jmedchem.1c00966

Reference yield:

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

: 167756-90-3
tert-butyl N-[(3-aminophenyl)methyl]-N-methylcarbamate

Guidance literature:: Multi-step reaction with 3 steps

1: NaHCO₃ / tetrahydrofuran / 25 °C

2: 1.) LDA / 1.) THF, cyclohexane, -78 deg C, 25 min, 2.) THF, cyclohexane, RT, 4 h

3: H₂ / 10percent Pd/C / ethyl acetate / 4 h

With hydrogen; sodium hydrogencarbonate; lithium diisopropyl amide; palladium on activated charcoal; In tetrahydrofuran; ethyl acetate;
DOI:10.1021/jm980072p