N-Acetylaminooctanoic acid

Base Information

• Chemical Name: N-Acetylaminooctanoic acid
• CAS No.: 80782-69-0
• Molecular Formula: C10H19NO3
• Molecular Weight: 201.26
• NSC Number: 20154
• DSSTox Substance ID: DTXSID401335973
• Nikkaji Number: J2.019.659I
• Wikidata: Q27162084
• Metabolomics Workbench ID: 199714
• Mol file: 80782-69-0.mol

Synonyms:2-(acetylamino)octanoic acid;N-acetyl-2-aminooctanoic acid

Chemical Property of N-Acetylaminooctanoic acid

Chemical Property:

• Boiling Point: 396.4°Cat760mmHg
• Flash Point: 193.5°C
• PSA: 66.40000
• Density: 1.034g/cm³
• LogP: 1.93700
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 201.13649347
• Heavy Atom Count: 14
• Complexity: 192

Purity/Quality:

99% ^*data from raw suppliers

2-AcetamidooctanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(C(=O)O)NC(=O)C

Technology Process of N-Acetylaminooctanoic acid

There total 1 articles about N-Acetylaminooctanoic 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:

(R)-α-aminooctanoic acid (106819-03-8,2187-07-7) + acetic anhydride (108-24-7) → (R)-2-acetylamino-octanoic acid (5440-37-9,80782-69-0,147254-03-3)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01599a030

upstream raw materials:

(R)-α-aminooctanoic acid

acetic anhydride