2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid
TL;DR: 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid (CAS 439587-15-2) 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-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic acid
Also Known As: 1,3-oxazinan-2-one, 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid, 2-FLUORO-4-(TRIFLUOROMETHYL)-DL-PHENYLALANINE, 2-F-4-trifluoromethyl-DL-Phe, 2-Fluoro-4-(trifluoromethyl)phenylalanine
| 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 | 439587-15-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)F)CC(C(=O)O)N |
Product Overview
2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid (CAS 439587-15-2), with molecular formula C10H9F4NO2 and molecular weight 251.06 g/mol. IUPAC: 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic acid.
Chemical Property Profile of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid
Property Insights of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid
The XLogP value of 1.7989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid. Following Lipinski's Rule of Five, 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]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 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid?
The CAS number of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid is 439587-15-2.
What is the molecular formula of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid?
The molecular formula of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid is C10H9F4NO2.
What is the molecular weight of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid?
The molecular weight of 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid is 251.06 g/mol.
Where can I buy 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid?
You can request a quote for 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.