2-[(Dodecylamino)carbonyl]benzoic acid

Base Information

• Chemical Name: 2-[(Dodecylamino)carbonyl]benzoic acid
• CAS No.: 59333-63-0
• Molecular Formula: C₂₀H₃₁NO₃
• Molecular Weight: 333.471
• DSSTox Substance ID: DTXSID101281935
• Mol file: 59333-63-0.mol

Synonyms:2-[(Dodecylamino)carbonyl]benzoic acid;SCHEMBL986325;DTXSID101281935;59333-63-0

Chemical Property of 2-[(Dodecylamino)carbonyl]benzoic acid

Chemical Property:

• XLogP3: 5.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 13
• Exact Mass: 333.23039385
• Heavy Atom Count: 24
• Complexity: 357

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCNC(=O)C1=CC=CC=C1C(=O)O

Technology Process of 2-[(Dodecylamino)carbonyl]benzoic acid

There total 6 articles about 2-[(Dodecylamino)carbonyl]benzoic 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: 59.0%

potassium phtalimide (1074-82-4) + N-n-dodecyl-5,6,8,9-tetrahydro-7-phenyldibenzoacridinium tetrafluoroborate → 2-(n-dodecylcarbamoyl)benzoic acid (59333-63-0)

Guidance literature:

With tetrabutylammonium tetrafluoroborate; In 1,4-dioxane; at 101 ℃; for 4h;

DOI:10.1039/P19810001492

Reference yield:

phthalic anhydride (85-44-9) + n-Dodecylamine (124-22-1) → 2-(n-dodecylcarbamoyl)benzoic acid (59333-63-0)

Guidance literature:

With boracic acid; In dichloromethane; at 35 ℃; for 0.25h;

DOI:10.1007/s11743-011-1325-9

Reference yield:

2-dodecylisoindoline-1,3-dione (27646-77-1) → 2-(n-dodecylcarbamoyl)benzoic acid (59333-63-0)

Guidance literature:

With sodium hydroxide;

upstream raw materials:

phthalic anhydride

n-Dodecylamine

2-dodecylisoindoline-1,3-dione

potassium phtalimide

Downstream raw materials:

C₂₀H₃₀NO₃^(1-)*Na⁽¹⁺⁾