171095-12-8

Basic information

• Product Name: (S)-N-ACETYL-4-BROMOPHENYLALANINE
• Synonyms: (S)-N-ACETYL-4-BROMOPHENYLALANINE;N-ACETYL-L-(4-BROMOPHENYL)ALANINE;N-ACETYL-3-(4-BROMOPHENYL)ALANINE;AC-L-PHE(4-BR)-OH;2-(ACETYLAMINO)-3-(4-BROMOPHENYL)PROPANOIC ACID;N-Acetyl-4-bromo-L-phenylalanine 95%;N-Acetyl-4-bromo-L-phenylalanine;(S)-2-AcetaMido-3-(4-broMophenyl)propanoic acid
• CAS NO: 171095-12-8
• Molecular Formula: C11H12BrNO3
• Molecular Weight: 286.12
• Mol File: 171095-12-8.mol
• Article Data: 6

Chemical Properties

• Melting Point: 191-193
• Boiling Point: 507.4°C at 760 mmHg
• Flash Point: 260.7°C
• Appearance: /
• Density: 1.514g/cm³
• Vapor Pressure: 4.07E-11mmHg at 25°C
• Refractive Index: 1.576
• PKA: 3.51±0.10(Predicted)
• CAS DataBase Reference: (S)-N-ACETYL-4-BROMOPHENYLALANINE(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-N-ACETYL-4-BROMOPHENYLALANINE(171095-12-8)
• EPA Substance Registry System: (S)-N-ACETYL-4-BROMOPHENYLALANINE(171095-12-8)

Safety Data

• Hazard Codes: Xi,Xn
• Statements: 22
• Hazardous Substances Data: 171095-12-8(Hazardous Substances Data)

Usage

General Description

(S)-N-ACETYL-4-BROMOPHENYLALANINE is a chemical compound with the molecular formula C13H14BrNO3. It is an amino acid derivative that contains a phenylalanine backbone with an acetyl group and a bromine atom attached to the aromatic ring. (S)-N-ACETYL-4-BROMOPHENYLALANINE is used in pharmaceutical research and drug development, particularly in the study of enzyme inhibitors and the design of novel anticancer and antiviral agents. It is also utilized in the synthesis of peptide-based drugs and bioactive compounds. Moreover, (S)-N-ACETYL-4-BROMOPHENYLALANINE has potential therapeutic applications in the treatment of certain diseases and medical conditions.

InChI:InChI=1/C11H12BrNO3/c1-7(14)13-10(11(15)16)6-8-2-4-9(12)5-3-8/h2-5,10H,6H2,1H3,(H,13,14)(H,15,16)/t10-/m0/s1

Upstream product

• 186605-19-6 4-(4-bromophenyl)methylene-2-methyl-5(4H)-oxazolone 
• 154192-52-6 C₁₁H₁₀BrNO₃ 
• 1122-91-4 4-bromo-benzaldehyde 
• 14091-15-7 p-bromo-DL-phenylalanine 
• 171095-12-8 N-acetyl-4-bromophenylalanine 
• 108-24-7 acetic anhydride 
• 1353886-56-2 ethyl 3-(4-bromophenyl)-2-(hydroxyimino)propionate 
• 140202-28-4 ethyl 4-bromo-N-acetylphenylalaninate 

Downstream Products

• 24250-84-8 H-p-BrPhe-OH 

Relevant articles and documents

Asymmetric synthesis of unnatural amino acids and tamsulosin chiral intermediate

An efficient and enantioselective hydrogenation of N-acetylamino phenyl acrylic acids was successfully developed by using ruthenium catalyst. This methodology is important in the field of pharmaceuticals and provides a new process for the preparation of unnatural amino acids and tamsulosin chiral intermediate.

Efficient kinetic resolution of amino acids catalyzed by lipase AS 'Amano' via cleavage of an amide bond

Herein the efficient kinetic resolution of non-natural alpha-amino acids catalyzed by lipase AS 'Amano' via cleaving the amide bond is reported. The starting materials were the corresponding amino acid amides and the amino acids were generated with ees of up to 99% with E values of >600. These results indicated that the lipase AS 'Amano' could be a powerful amide hydrolase for the kinetic resolution of amino acid starting from the corresponding amino acid amides.

Novel atropisomeric bisphosphine ligands with a bridge across the 5,5′-position of the biphenyl for asymmetric catalysis

A new type of atropisomeric bisphosphine ligand 2 with a bridge across the 5,5′-position of the biphenyl has been developed. The axial chirality of this type of ligands can be retained by macrocyclic ring strain produced from 5,5′-linkage of the biphenyl