N-Boc-2-amino-5-bromobenzaldehyde

Base Information

• Chemical Name: N-Boc-2-amino-5-bromobenzaldehyde
• CAS No.: 199273-16-0
• Molecular Formula: C12H14BrNO3
• Molecular Weight: 300.15
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID30596300
• Wikidata: Q82491524
• Mol file: 199273-16-0.mol

Synonyms:N-Boc-2-amino-5-bromobenzaldehyde;199273-16-0;tert-Butyl (4-bromo-2-formylphenyl)carbamate;TERT-BUTYL N-(4-BROMO-2-FORMYLPHENYL)CARBAMATE;tert-Butyl(4-bromo-2-formylphenyl)carbamate;Carbamic acid, (4-bromo-2-formylphenyl)-, 1,1-dimethylethyl ester (9CI);SCHEMBL8140376;DTXSID30596300;ZHA27316;Carbamic acid, (4-bromo-2-formylphenyl)-, 1,1-dimethylethyl ester;MFCD11617307;AKOS022175284;AS-36741;CS-0171828;tert-Butyl (4-bromo-2-formylphenyl)carbamatato;EN300-1178106;A919460;Z1505706424

Chemical Property of N-Boc-2-amino-5-bromobenzaldehyde

Chemical Property:

• PSA: 55.40000
• LogP: 3.68160
• Storage Temp.: 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 299.01571
• Heavy Atom Count: 17
• Complexity: 288

Purity/Quality:

97% ^*data from raw suppliers

tert-Butyl(4-bromo-2-formylphenyl)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)NC1=C(C=C(C=C1)Br)C=O

Technology Process of N-Boc-2-amino-5-bromobenzaldehyde

There total 1 articles about N-Boc-2-amino-5-bromobenzaldehyde 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:

oxalyl dichloride (79-37-8) + 5-Bromo-2-N-Boc-Amino-Benzyl Alcohol (199273-09-1) → 5-Bromo-2-N-Boc-Amino-Benzaldehyde (199273-16-0)

Guidance literature:

With triethylamine; In dichloromethane; dimethyl sulfoxide;

Reference yield: 78.0%

5-Bromo-2-N-Boc-Amino-Benzaldehyde (199273-16-0) + (triphenylphosphoranylidene)acetaldehyde (2136-75-6) → tert-butyl (E)-(4-bromo-2-(3-oxoprop-1-en-1-yl)phenyl)carbamate

Guidance literature:

In toluene; at 90 ℃; for 3h;

DOI:10.1021/acs.joc.0c00893

upstream raw materials:

oxalyl dichloride

5-Bromo-2-N-Boc-Amino-Benzyl Alcohol