3-amino-3-(3,5-dimethylphenyl)propanoic Acid

Base Information

• Chemical Name: 3-amino-3-(3,5-dimethylphenyl)propanoic Acid
• CAS No.: 293330-11-7
• Molecular Formula: C₁₁H₁₅NO₂
• Molecular Weight: 193.246
• DSSTox Substance ID: DTXSID001270214
• Mol file: 293330-11-7.mol

Synonyms:3-(3,5-Dimethylphenyl)-beta-alanine;3-amino-3-(3,5-dimethylphenyl)propanoic Acid;293330-11-7;3-Amino-3-(3,5-dimethyl-phenyl)-propionic acid;Oprea1_416397;SCHEMBL2981782;YBIJIOITROSVBG-UHFFFAOYSA-N;DTXSID001270214;BBL022143;MFCD01871321;STK137972;AKOS001476069;s11359;BS-32226;BB 0249721;beta-Amino-3,5-dimethylbenzenepropanoic acid;CS-0206911;EN300-816582;3-Amino-3-(3,5-dimethyl-phenyl)-propionic acid

Chemical Property of 3-amino-3-(3,5-dimethylphenyl)propanoic Acid

Chemical Property:

• XLogP3: -1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 193.110278721
• Heavy Atom Count: 14
• Complexity: 196

Purity/Quality:

99% ^*data from raw suppliers

3-(3,5-Dimethylphenyl)-β-alanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1)C(CC(=O)O)N)C
• Uses: 3-(3,5-Dimethylphenyl)-beta-alanine

Technology Process of 3-amino-3-(3,5-dimethylphenyl)propanoic Acid

There total 1 articles about 3-amino-3-(3,5-dimethylphenyl)propanoic 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: 47.0%

malonic acid (141-82-2) + 3,5-dimethylbenzaldehyde (5779-95-3) → 3-amino-3-(3,5-dimethylphenyl)propanoic acid (293330-11-7)

Guidance literature:

With ammonium acetate; In isopropyl alcohol; Reflux;

DOI:10.1021/ml5002079

Reference yield: 80.0%

3-amino-3-(3,5-dimethylphenyl)propanoic acid (293330-11-7) + ethanol (64-17-5) → C13H19NO2*ClH

Guidance literature:

With thionyl chloride; at -15 ℃; Reflux; Inert atmosphere;

DOI:10.1021/ml5002079

Reference yield:

3-amino-3-(3,5-dimethylphenyl)propanoic acid (293330-11-7) → (RS)-ethyl 3-(3,5-dimethylphenyl)-3-(5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanamido)propanoate

Guidance literature:

Multi-step reaction with 2 steps

1: thionyl chloride / -15 °C / Reflux; Inert atmosphere

2: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol; 4-methyl-morpholine / acetonitrile / 24 h / 20 °C / Inert atmosphere

With 4-methyl-morpholine; thionyl chloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In acetonitrile;

DOI:10.1021/ml5002079

upstream raw materials:

malonic acid

3,5-dimethylbenzaldehyde

Downstream raw materials:

ethyl 3-amino-3-(3,5-dimethylphenyl)propanoate

(CH₃)2C₆H₃CH(NH₂)CH₂COOC₂H₅

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 293330-11-7 3-(3,5-DIMETHYLPHENYL)-BETA-ALANINE

Send

Send

Metric Ton KG G Pound L ML

Send

Send