![3-[(3,5-Dimethylphenyl)amino]propanoic acid structure](/static/products/3605/36053-83-5.webp)
3-[(3,5-Dimethylphenyl)amino]propanoic acid
TL;DR: 3-[(3,5-Dimethylphenyl)amino]propanoic acid (CAS 36053-83-5) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethylanilino)propanoic acid
Also Known As: 3-[(3,5-dimethylphenyl)amino]propanoic acid, 3-(3,5-Dimethyl-phenylamino)-propionic acid, 3-(3,5-dimethylanilino)propanoic acid, b-Alanine, N-(3,5-dimethylphenyl)-, N-(3,5-Dimethylphenyl)-beta-alanine
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 2.19004 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 313.80945 |
Chemical Identifiers
| CAS Number | 36053-83-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NCCC(=O)O)C |
Product Overview
3-[(3,5-Dimethylphenyl)amino]propanoic acid (CAS 36053-83-5), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 3-(3,5-dimethylanilino)propanoic acid.
Chemical Property Profile of 3-[(3,5-Dimethylphenyl)amino]propanoic acid
Property Insights of 3-[(3,5-Dimethylphenyl)amino]propanoic acid
The XLogP value of 2.19004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(3,5-Dimethylphenyl)amino]propanoic acid. With a topological polar surface area (TPSA) of 49.33 Ų, 3-[(3,5-Dimethylphenyl)amino]propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3,5-Dimethylphenyl)amino]propanoic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(3,5-Dimethylphenyl)amino]propanoic acid?
The CAS number of 3-[(3,5-Dimethylphenyl)amino]propanoic acid is 36053-83-5.
What is the molecular formula of 3-[(3,5-Dimethylphenyl)amino]propanoic acid?
The molecular formula of 3-[(3,5-Dimethylphenyl)amino]propanoic acid is C11H15NO2.
What is the molecular weight of 3-[(3,5-Dimethylphenyl)amino]propanoic acid?
The molecular weight of 3-[(3,5-Dimethylphenyl)amino]propanoic acid is 193.11 g/mol.
Where can I buy 3-[(3,5-Dimethylphenyl)amino]propanoic acid?
You can request a quote for 3-[(3,5-Dimethylphenyl)amino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3,5-Dimethylphenyl)amino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3,5-Dimethylphenyl)amino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.