tert-Butyl (2-(3-aminophenoxy)ethyl)carbamate

Base Information

• Chemical Name: tert-Butyl (2-(3-aminophenoxy)ethyl)carbamate
• CAS No.: 246240-10-8
• Molecular Formula: C13H20N2O3
• Molecular Weight: 252.313
• European Community (EC) Number: 868-771-3
• Mol file: 246240-10-8.mol

Synonyms:246240-10-8;tert-Butyl (2-(3-aminophenoxy)ethyl)carbamate;Tert-butyl N-[2-(3-aminophenoxy)ethyl]carbamate;tert-Butyl [2-(3-aminophenoxy)ethyl]carbamate;tert-butyl 2-(3-aminophenoxy)ethylcarbamate;SCHEMBL541782;LODFQJNQDJFGQU-UHFFFAOYSA-N;MFCD11922407;AKOS010259729;CS-0450304;FT-0715087;t-Butyl [2-(3-aminophenoxy)ethyl]carbamate;EN300-68575;tert-Butyl(2-(3-aminophenoxy)ethyl)carbamate;C78093;3-[2-(tert.butyloxycarbonylamino)ethoxy]-aniline;A1-29263;Z733882926

Chemical Property of tert-Butyl (2-(3-aminophenoxy)ethyl)carbamate

Chemical Property:

• PSA: 73.58000
• LogP: 3.14440
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 252.14739250
• Heavy Atom Count: 18
• Complexity: 264

Purity/Quality:

99% ^*data from raw suppliers

tert-Butyl(2-(3-aminophenoxy)ethyl)carbamate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCCOC1=CC=CC(=C1)N

Technology Process of tert-Butyl (2-(3-aminophenoxy)ethyl)carbamate

There total 5 articles about tert-Butyl (2-(3-aminophenoxy)ethyl)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: 90.0%

tert-butyl (2-(3-nitrophenoxy)ethyl)carbamate (246240-09-5) → tert-butyl (2-(3-aminophenoxy)ethyl)carbamate (246240-10-8)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃; for 4h;

Reference yield: 58.0%

m-Hydroxyaniline (591-27-5) + 2-(tert-butoxycarbonylamino)ethyl-4-methylbenzenesulfonate (158690-56-3) → tert-butyl (2-(3-aminophenoxy)ethyl)carbamate (246240-10-8)

Guidance literature:

With caesium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 15h; Inert atmosphere;

Reference yield:

2-(tert-butoxycarbonylamino)ethyl bromide (39684-80-5) → tert-butyl (2-(3-aminophenoxy)ethyl)carbamate (246240-10-8)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 16 h / 20 - 50 °C

2: palladium 10% on activated carbon; hydrogen / methanol / 4 h / 20 °C

With palladium 10% on activated carbon; hydrogen; potassium carbonate; In methanol; N,N-dimethyl-formamide;

upstream raw materials:

2-(tert-butoxycarbonylamino)ethyl bromide

tert-butyl (2-(3-nitrophenoxy)ethyl)carbamate

m-Hydroxyaniline

2-(tert-butoxycarbonylamino)ethyl-4-methylbenzenesulfonate

Downstream raw materials:

2-[3-(tert-butylcarbamoyl-N-ethyloxy)phenylamino]-6-(3-acetamidophenyl)pyrazine

3-[[5-cyano-2-[[3-[2-[[(1,1-dimethylethoxy)carbonyl]amino]ethoxy]phenyl]amino]-4-pyrimidinyl]amino]-benzoic acid 1,1-dimethylethyl ester

C₂₃H₂₆N₆O₅

tert-butyl 2-(3-(3-cyclohexylthioureido)phenoxy)ethylcarbamate