220587-29-1

Basic information

• Product Name: (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate
• Synonyms: (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate;Methyl (2S)-2-[(tert-butoxycarbonyl)amino]-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanoate;L-Phenylalanine, N-[(1,1-diMethylethoxy)carbonyl]-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-, Methyl ester;2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate;N-Boc-(3S,4S)-4-amino-3-hydroxy-5-phenyl pentanoic acid;methyl(S)-2-((tert-butoxycarbonyl)amino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate;4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-hydroxy-5-phenylpentanoic acid;N-Boc-(3S,4S)-AHPPA
• CAS NO: 220587-29-1
• Molecular Formula: C₂₁H₃₂BNO₆
• Molecular Weight: 405.29
• Mol File: 220587-29-1.mol
• Article Data: 22

Chemical Properties

• Boiling Point: 521.897 °C at 760 mmHg
• Flash Point: 269.434 °C
• Appearance: /
• Density: 1.10
• Storage Temp.: 2-8°C
• PKA: 10.96±0.46(Predicted)
• CAS DataBase Reference: (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate(220587-29-1)
• EPA Substance Registry System: (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate(220587-29-1)

Safety Data

• Hazardous Substances Data: 220587-29-1(Hazardous Substances Data)

Usage

General Description

The chemical compound "(S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate" is a complex organic molecule that contains a variety of functional groups including esters, amines, and boron-containing groups. It is a chiral compound, with the (S)-methyl group indicating a specific stereochemistry. (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate may have potential applications in organic synthesis, medicinal chemistry, or materials science due to its unique structure and functional groups. Its specific properties and potential uses would depend on further characterization and study in a laboratory setting.

Upstream product

• 69942-12-7 N-tert-butoxycarbonylserine methyl ester 
• 175844-11-8 methyl (2R)-2-[(tert-butoxycarbonyl)amino]-3-bromopropionate 
• 68716-49-4 p-bromophenylboronic acid pinacol ester 
• 99359-33-8 (S)-methyl 2-amino-3-(4-bromophenyl)propanoate 
• 24250-84-8 H-p-BrPhe-OH 
• 63-91-2 L-phenylalanine 
• 1991-81-7 4-iodo-L-phenylalanine 
• 103882-09-3 N-Boc-4-I-Phe-OH 
• 113850-76-3 N-(tert-butoxycarbonyl)-4-iodo-L-phenylalanine methyl ester 
• 73183-34-3 bis(pinacol)diborane 
• 24424-99-5 di-tert-butyl dicarbonate 
• 62129-39-9 4-bromo-N-{[(1,1-dimethylethyl)oxy]carbonyl}-L-phenylalanine 
• 266306-18-7 (S)-3-(4-Bromo-phenyl)-2-tert-butoxycarbonylamino-propionic acid methyl ester 
• 4326-36-7 (S)-N-(tert-butoxycarbonyl)tyrosine methyl ester 

Downstream Products

• 216439-76-8 (S)-methyl 2-(tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoate 
• 156017-43-5 (2S)-{4-[2-tert-butoxycarbonylamino-2-(methoxycarbonyl)-ethyl]-phenyl}difluoromethyl-phosphonic acid diethyl ester 
• 224824-22-0 (S)-(4-(2-((tert-butoxycarbonyl)amino)-3-methoxy-3-oxopropyl)phenyl)boronic acid 

Relevant articles and documents

Enantioselective synthesis of 4-substituted phenylalanines by cross- coupling reactions

The enantiomerically enriched BOC-protected (4- pinacolylborono)phenylalanine methyl ester (8) is produced via enzymatic resolution of the racemic material, or direct synthesis from the corresponding iodide (or triflate), and undergoes Suzuki-Miyaura coup

Rhodium-Catalyzed Dealkenylative Arylation of Alkenes with Arylboronic Compounds

The C?C bond formation reaction represents a fundamental and important transformation in synthetic chemistry, and exploring new types of C?C bond formation reactions is recognized as appealing, yet challenging. Herein, we disclose the first example of rhodium-catalyzed dealkenylative arylation of alkenes with arylboronic compounds, thereby providing an unconventional access to bi(hetero)aryls with excellent chemoselectivity. In this method, C(aryl)?C(alkenyl) and C(alkenyl)?C(alkenyl) bonds in various alkenes and 1,3-dienes can be cleaved via a hydrometalation and followed by β-carbon elimination pathway for Suzuki–Miyaura reactions. Furthermore, a series of novel organic fluorescent molecules with excellent photophysical properties has been efficiently constructed with this protocol.

Process Development of Tryptophan Hydroxylase Inhibitor LX1031, a Drug Candidate for the Treatment of Irritable Bowel Syndrome

Two process routes for LX1031, a tryptophan hydroxylase inhibitor for the treatment of irritable bowel syndrome, were developed. They shared the same left-hand and right-hand starting materials as well as the penultimate intermediate. The chiral center in