![ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate structure](/static/products/128/1285523-99-0.webp)
ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate
TL;DR: ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate (CAS 1285523-99-0) is a chemical compound with molecular formula C12H14F3NO2 and molecular weight 261.09766 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate
Also Known As: ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate, Ethyl 3-amino-3-[3-(trifluoromethyl)phenyl]propanoate
Technical Specifications
| Molecular Formula | C12H14F3NO2 |
| Molecular Weight | 261.09766 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.09766 Da |
| Heavy Atoms | 18 |
| Complexity | 281.0 |
| SMILES | CCOC(=O)C[C@H](C1=CC(=CC=C1)C(F)(F)F)N |
| InChIKey | LWNDERJMKXNISZ-SNVBAGLBSA-N |
Chemical Property Profile of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate
Property Insights of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate. With a topological polar surface area (TPSA) of 52.3 Ų, ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate has 1 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 ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate?
The CAS number of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate is 1285523-99-0.
What is the molecular formula of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate?
The molecular formula of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate is C12H14F3NO2.
What is the molecular weight of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate?
The molecular weight of ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate is 261.09766 g/mol.
Where can I buy ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate?
You can request a quote for ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate?
Yes, CoreyChem provides custom synthesis services for ethyl (3R)-3-amino-3-[3-(trifluoromethyl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.