Benzyl (4-broMo-3-fluorophenyl)carbaMate

Base Information

• Chemical Name: Benzyl (4-broMo-3-fluorophenyl)carbaMate
• CAS No.: 510729-01-8
• Molecular Formula: C14H11BrFNO2
• Molecular Weight: 324.149
• Hs Code.: 2924297099
• Mol file: 510729-01-8.mol

Synonyms:Benzyl (4-broMo-3-fluorophenyl)carbaMate;4-Bromo-3-fluoroaniline, N-CBZ protected;Benzyl (4-bromo-3-fluorophenyl)carbamate, Phenylmethyl (4-bromo-3-fluorophenyl)carbamate;N-Cbz 4-BroMo-3-fluoroaniline;(4-Bromo-3-fluorophenyl)carbamic acid benzyl ester

Chemical Property of Benzyl (4-broMo-3-fluorophenyl)carbaMate

Chemical Property:

• Boiling Point: 359.7±42.0 °C(Predicted)
• PKA: 12.14±0.70(Predicted)
• PSA: 41.82000
• Density: 1.543±0.06 g/cm3(Predicted)
• LogP: 4.35050
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Methanol (Slightly)

Purity/Quality:

99%, ^*data from raw suppliers

(4-Bromo-3-fluorophenyl)carbamicAcidBenzylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: (4-Bromo-3-fluorophenyl)carbamic Acid Benzyl Ester is an intermediate in the synthesis of Tedizolid (T013750), an known oral and intravenous antibiotic.

Technology Process of Benzyl (4-broMo-3-fluorophenyl)carbaMate

There total 1 articles about Benzyl (4-broMo-3-fluorophenyl)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%

3-fluoro-4-bromophenylamine (656-65-5) + benzyl chloroformate (501-53-1,94274-21-2) → (4-bromo-3-fluorophenyl)carbamic acid benzyl ester (510729-01-8)

Guidance literature:

With sodium hydrogencarbonate; In acetone; at 15 - 22 ℃; for 1.5h;

Reference yield: 95.0%

(4-bromo-3-fluorophenyl)carbamic acid benzyl ester (510729-01-8) → 2-fluoro-4-(benzyloxycarbonyl)aminophenylboronic acid (874290-59-2)

Guidance literature:

(4-bromo-3-fluorophenyl)carbamic acid benzyl ester; With isopropylmagnesium bromide; In tetrahydrofuran; at -10 ℃; for 5h;

With n-butyllithium; In tetrahydrofuran; hexane; at -10 ℃; for 1h;

With Trimethyl borate; In tetrahydrofuran; hexane; at -10 ℃; for 2h; Time;

Reference yield: 88.0%

2-(2-methyl-2H-tetrazol-5-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine (1056039-83-8) + (4-bromo-3-fluorophenyl)carbamic acid benzyl ester (510729-01-8) → 3-fluoro-4-(6-(2-methyl-2H-tetrazole-5-yl)pyridin-3-yl)phenyl-carbamic acid benzylester (1220910-89-3)

Guidance literature:

With potassium carbonate; In water; at 80 ℃; for 12h; Inert atmosphere;

upstream raw materials:

3-fluoro-4-bromophenylamine

benzyl chloroformate

Downstream raw materials:

2-fluoro-4-(benzyloxycarbonyl)aminophenylboronic acid

C₁₉H₂₂BFN₂O₆

(S)‐N‐((3‐(3‐fluoro‐4‐(4,4,5,5‐tetramethyl‐1,3,2‐dioxaborolan‐2‐yl)phenyl)‐2‐oxooxazolidin‐5‐yl)methyl)acetamide

C₂₁H₂₁FN₆O₄

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