3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine
TL;DR: 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine (CAS 1259992-93-2) is a chemical compound with molecular formula C10H9F4NO2 and molecular weight 251.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[3-fluoro-5-(trifluoromethyl)phenyl]propanoic acid
Also Known As: 3-FLUORO-5-(TRIFLUOROMETHYL)-DL-PHENYLALANINE, 2-Amino-3-(3-fluoro-5-(trifluoromethyl)phenyl)propanoic acid, 2-amino-3-[3-fluoro-5-(trifluoromethyl)phenyl]propanoic Acid, 2-amino-3-[5-fluoro-3-(trifluoromethyl)phenyl]propanoic acid, 2-Amino-3-[3-fluoro-?5-(triflu?oromethyl?)phen?yl]propionic acid
| Molecular Formula | C10H9F4NO2 |
|---|---|
| Molecular Weight | 251.06 g/mol |
| LogP | 1.7989 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.05695 |
| Heavy Atoms | 17 |
| Complexity | 430.80435 |
Chemical Identifiers
| CAS Number | 1259992-93-2 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)F)CC(C(=O)O)N |
Product Overview
3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine (CAS 1259992-93-2), with molecular formula C10H9F4NO2 and molecular weight 251.06 g/mol. IUPAC: 2-amino-3-[3-fluoro-5-(trifluoromethyl)phenyl]propanoic acid.
Chemical Property Profile of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine
Property Insights of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine
The XLogP value of 1.7989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine. Following Lipinski's Rule of Five, 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine 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-Fluoro-5-(trifluoromethyl)-DL-phenylalanine?
The CAS number of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine is 1259992-93-2.
What is the molecular formula of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine?
The molecular formula of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine is C10H9F4NO2.
What is the molecular weight of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine?
The molecular weight of 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine is 251.06 g/mol.
Where can I buy 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine?
You can request a quote for 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-5-(trifluoromethyl)-DL-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.