Acetylalanylalanine

Base Information

• Chemical Name: Acetylalanylalanine
• CAS No.: 19993-26-1
• Molecular Formula: C8H14 N2 O4
• Molecular Weight: 202.21
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID40173808
• Nikkaji Number: J933.509I
• Wikidata: Q83043836
• ChEMBL ID: CHEMBL2372592
• Mol file: 19993-26-1.mol

Synonyms:Ac-D-Ala-D-Ala;acetyl-Ala-Ala;acetyl-D-alanyl-D-alanine;acetylalanylalanine;acetylalanylalanine, (L)-isomer;N-acetyl-alanyl-alanine;N-acetyl-L-alanyl-L-alanine

Chemical Property of Acetylalanylalanine

Chemical Property:

• Vapor Pressure: 2.96E-13mmHg at 25°C
• Boiling Point: 543.6oC at 760 mmHg
• Flash Point: 282.5oC
• PSA: 95.50000
• Density: 1.204g/cm3
• LogP: -0.11790
• Storage Temp.: −20°C
• Solubility.: Methanol (Slightly), Water (Slightly, Sonicated)
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 202.09535693
• Heavy Atom Count: 14
• Complexity: 252

Purity/Quality:

99% ^*data from raw suppliers

N-?Acetyl-?D-?alanyl-D-alanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)NC(C)C(=O)O)NC(=O)C
• Isomeric SMILES: C[C@@H](C(=O)N[C@@H](C)C(=O)O)NC(=O)C
• Uses: N-?Acetyl-?D-?alanyl-D-alanine was used as the target in the target-accelerated combinatorial synthesis of vancomycin dimers. D-Ala-D-Ala possess the greatest affinity for vancomycin. Vancomycin and N-?Acetyl-?D-?alanyl-D-alanine are used as a model system to demonstrate the use of affinity capillary eletrophoresis.

Technology Process of Acetylalanylalanine

There total 1 articles about Acetylalanylalanine 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:

D-alanyl-D-alanine (923-16-0,110652-05-6,210687-33-5,2392-61-2) + acetic anhydride (108-24-7) → (R)-2-((R)-2-Acetylamino-propionylamino)-propionic acid (19993-26-1)

Guidance literature:

In water;

DOI:10.1021/ja00343a043

upstream raw materials:

D-alanyl-D-alanine

acetic anhydride