3-Amino-3-(2,4-dimethylphenyl)propanoic acid
TL;DR: 3-Amino-3-(2,4-dimethylphenyl)propanoic acid (CAS 117391-54-5) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-3-(2,4-dimethylphenyl)propanoic acid
Also Known As: 3-amino-3-(2,4-dimethylphenyl)propanoic acid, RARECHEM AK HC T312, 9947AC, Benzenepropanoic acid, beta-amino-2,4-dimethyl-, 3-(2,4-dimethylphenyl)-beta-alanine
Technical Specifications
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
| SMILES | CC1=CC(=C(C=C1)C(CC(=O)O)N)C |
| InChIKey | LRMMWNSBHJFPEE-UHFFFAOYSA-N |
Chemical Property Profile of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid
Property Insights of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid
The XLogP value of -1.2 indicates that 3-Amino-3-(2,4-dimethylphenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-3-(2,4-dimethylphenyl)propanoic acid. Following Lipinski's Rule of Five, 3-Amino-3-(2,4-dimethylphenyl)propanoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid?
The CAS number of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid is 117391-54-5.
What is the molecular formula of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid?
The molecular formula of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid is C11H15NO2.
What is the molecular weight of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid?
The molecular weight of 3-Amino-3-(2,4-dimethylphenyl)propanoic acid is 193.11028 g/mol.
Where can I buy 3-Amino-3-(2,4-dimethylphenyl)propanoic acid?
You can request a quote for 3-Amino-3-(2,4-dimethylphenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Amino-3-(2,4-dimethylphenyl)propanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-Amino-3-(2,4-dimethylphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.