3-Amino-4-ethyloctanoic acid

Base Information

• Chemical Name: 3-Amino-4-ethyloctanoic acid
• CAS No.: 103905-71-1
• Molecular Formula: C₁₀H₂₁NO₂
• Molecular Weight: 187.282
• DSSTox Substance ID: DTXSID10697344
• Mol file: 103905-71-1.mol

Synonyms:3-amino-4-ethyloctanoic acid;103905-71-1;3-AMINO-4-ETHYL-OCTANOIC ACID;DTXSID10697344;3-AMINO-4-ETHYL-OCTANOICACID;AKOS006294734

Chemical Property of 3-Amino-4-ethyloctanoic acid

Chemical Property:

• PSA: 63.32000
• LogP: 2.70510
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 187.157228913
• Heavy Atom Count: 13
• Complexity: 148

Purity/Quality:

99%min ^*data from raw suppliers

3-Amino-4-ethyl-octanoicacid 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)C(CC(=O)O)N

Technology Process of 3-Amino-4-ethyloctanoic acid

There total 1 articles about 3-Amino-4-ethyloctanoic 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:

d,l-2-ethylhexanal (123-05-7) + malonic acid (141-82-2) → 4-ethyl-3-amino-octanoic acid (103905-71-1)

Guidance literature:

With ethanol; ammonia; racemat of F. 167;

Reference yield:

4-ethyl-3-amino-octanoic acid (103905-71-1) → (3Ξ,4Ξ)-4-ethyl-3-amino-octanoic acid-((1R)-menthyl ester)

Guidance literature:

With thionyl chloride; Behandeln des Reaktionsprodukts mit (1R)-Menthol und Aether;

upstream raw materials:

d,l-2-ethylhexanal

malonic acid