(3S)-3-[[3-[[4-(TRIFLUOROMETHYL)BENZOYL]AMINO]PHENYL]METHOXY]-L-ASPARTIC ACID

Base Information

• Chemical Name: (3S)-3-[[3-[[4-(TRIFLUOROMETHYL)BENZOYL]AMINO]PHENYL]METHOXY]-L-ASPARTIC ACID
• CAS No.: 480439-73-4
• Molecular Formula: C₁₉H₁₇F₃N₂O₆
• Molecular Weight: 426.349
• Mol file: 480439-73-4.mol

Synonyms:TFB-TBOA;

Chemical Property of (3S)-3-[[3-[[4-(TRIFLUOROMETHYL)BENZOYL]AMINO]PHENYL]METHOXY]-L-ASPARTIC ACID

Chemical Property:

• Boiling Point: 513.6±50.0 °C(Predicted)
• PKA: 2.05±0.27(Predicted)
• PSA: 138.95000
• Density: 1.500±0.06 g/cm3(Predicted)
• LogP: 3.11270
• Storage Temp.: Store at -20°C

Purity/Quality:

97% ^*data from raw suppliers

TFB-TBOA ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: TFB-TBOA is a novel glutamate transporter blocker.

Technology Process of (3S)-3-[[3-[[4-(TRIFLUOROMETHYL)BENZOYL]AMINO]PHENYL]METHOXY]-L-ASPARTIC ACID

There total 12 articles about (3S)-3-[[3-[[4-(TRIFLUOROMETHYL)BENZOYL]AMINO]PHENYL]METHOXY]-L-ASPARTIC ACID 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: 96.0%

C32H41F3N2O8 → C19H17F3N2O6 (480439-73-4)

Guidance literature:

With trifluoroacetic acid; In chloroform; at 20 ℃;

DOI:10.1021/acschemneuro.5b00311

Reference yield: 82.0%

C32H41F3N2O8 → C19H17F3N2O6 (480439-73-4)

Guidance literature:

With trifluoroacetic acid; In chloroform; at 20 ℃;

DOI:10.1021/acschemneuro.5b00311

Reference yield: 59.0%

C21H21F3N2O6*C2HF3O2 → (2S,3S)-2-amino-3-((3-(4-(trifluoromethyl)-benzamido)benzyl)oxy)succinic acid (480439-73-4)

Guidance literature:

C₂₁H₂₁F₃N₂O₆*C₂HF₃O₂; With lithium hydroxide; In tetrahydrofuran; water; at 20 ℃; for 2h;

With hydrogenchloride; In water; pH=1; enantioselective reaction;

DOI:10.1039/c7ob00305f

upstream raw materials:

N-(3-(hydroxymethyl)phenyl)-4-(trifluoromethyl)benzamide

3-aminobenzenemethanol

4-trifluoromethyl-phenyl acetyl chloride