4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER

Base Information

• Chemical Name: 4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER
• CAS No.: 437707-51-2
• Molecular Formula: C9H9 Br I N O2
• Molecular Weight: 369.984
• Hs Code.: 2922499990
• Mol file: 437707-51-2.mol

Synonyms:ETHYL 4-AMINO-3-BROMO-5-IODOBENZOATE;4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER

Chemical Property of 4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER

Chemical Property:

• Boiling Point: 407.6±45.0 °C(Predicted)
• PKA: -1.62±0.10(Predicted)
• PSA: 52.32000
• Density: 2.006±0.06 g/cm3(Predicted)
• LogP: 3.39380
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C

Purity/Quality:

97% ^*data from raw suppliers

4-Amino-3-bromo-5-iodo-benzoicacidethylester ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER

There total 2 articles about 4-AMINO-3-BROMO-5-IODO-BENZOIC ACID ETHYL ESTER 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: 94.0%

ethyl 3-bromo-4-aminobenzoate (7149-03-3) → ethyl 4-amino-3-bromo-5-iodobenzoate (437707-51-2)

Guidance literature:

With Iodine monochloride; In water; acetic acid; at 80 ℃; for 10h;

DOI:10.1021/ja012458m

Reference yield:

p-aminoethylbenzoate (94-09-7) → ethyl 4-amino-3-bromo-5-iodobenzoate (437707-51-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 99 percent / N-bromosuccinimide / CHCl₃ / 4 h / 5 - 10 °C

2: 94 percent / ICl / acetic acid; H₂O / 10 h / 80 °C

With N-Bromosuccinimide; Iodine monochloride; In chloroform; water; acetic acid;

DOI:10.1021/ja012458m

Reference yield: 88.0%

ethyl 4-amino-3-bromo-5-iodobenzoate (437707-51-2) → ethyl 3-bromo-5-iodobenzoate (186772-44-1)

Guidance literature:

With sulfuric acid; sodium nitrite; In ethanol; benzene; for 1.5h; Heating;

DOI:10.1021/ja012458m

upstream raw materials:

ethyl 3-bromo-4-aminobenzoate

p-aminoethylbenzoate

Downstream raw materials:

ethyl 3-bromo-5-iodobenzoate

ethyl 3-bromo-5-[(triisopropylsilyl)ethynyl]benzoate

ethyl 3-[(trimethylsilyl)ethynyl]-5-[(triisopropylsilyl)ethynyl]benzoate

hexadecyl 3-ethynyl-5-[(triisopropylsilyl)ethynyl]benzoate