Butanoic acid, 2-[(4-methylphenyl)amino]-

Base Information

• Chemical Name: Butanoic acid, 2-[(4-methylphenyl)amino]-
• CAS No.: 117755-96-1
• Molecular Formula: C₁₁H₁₅NO₂
• Molecular Weight: 193.246
• DSSTox Substance ID: DTXSID401272298
• Mol file: 117755-96-1.mol

Synonyms:117755-96-1;SCHEMBL11196579;DTXSID401272298;AKOS000100374;Butanoic acid, 2-[(4-methylphenyl)amino]-

Chemical Property of Butanoic acid, 2-[(4-methylphenyl)amino]-

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 193.110278721
• Heavy Atom Count: 14
• Complexity: 186

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(C(=O)O)NC1=CC=C(C=C1)C

Technology Process of Butanoic acid, 2-[(4-methylphenyl)amino]-

There total 1 articles about Butanoic acid, 2-[(4-methylphenyl)amino]- 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:

2-Bromobutyric acid (80-58-0) + p-toluidine (106-49-0,12221-03-3) → 2-p-toluidino-butyric acid (117755-96-1)

Guidance literature:

DOI:10.1021/jo01096a009

Reference yield:

2-p-toluidino-butyric acid (117755-96-1) → 3,6-diethyl-1,4-di-p-tolyl-piperazine-2,5-dione

Guidance literature:

With acetic anhydride; at 160 ℃; lower-melting form;

Reference yield:

2-p-toluidino-butyric acid (117755-96-1) → 3,6-diethyl-1,4-di-p-tolyl-piperazine-2,5-dione

Guidance literature:

With acetic anhydride; at 160 ℃; higher-melting form;

upstream raw materials:

2-Bromobutyric acid

p-toluidine

Downstream raw materials:

N-propyl-p-tolylamine