3-Chloro-5-(trifluoromethyl)-DL-phenylalanine
TL;DR: 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine (CAS 1259961-84-6) is a chemical compound with molecular formula C10H9ClF3NO2 and molecular weight 267.0274 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-[3-chloro-5-(trifluoromethyl)phenyl]propanoic acid
Also Known As: 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine, 2-amino-3-[3-chloro-5-(trifluoromethyl)phenyl]propanoic Acid, 2-Amino-3-(3-chloro-5-(trifluoromethyl)phenyl)propanoic acid, 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine (H-DL-Phe(3-Cl,5-CF3)-OH)
Technical Specifications
| Molecular Formula | C10H9ClF3NO2 |
| Molecular Weight | 267.0274 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.0274 Da |
| Heavy Atoms | 17 |
| Complexity | 285.0 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)Cl)CC(C(=O)O)N |
| InChIKey | OEDKFVILMRZCHJ-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine
Property Insights of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine. Following Lipinski's Rule of Five, 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine has 2 hydrogen bond donor(s) and 6 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-Chloro-5-(trifluoromethyl)-DL-phenylalanine?
The CAS number of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine is 1259961-84-6.
What is the molecular formula of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine?
The molecular formula of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine is C10H9ClF3NO2.
What is the molecular weight of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine?
The molecular weight of 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine is 267.0274 g/mol.
Where can I buy 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine?
You can request a quote for 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine?
Yes, CoreyChem provides custom synthesis services for 3-Chloro-5-(trifluoromethyl)-DL-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.