4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid
TL;DR: 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid (CAS 135235-94-8) is a chemical compound with molecular formula C12H9F6NO3 and molecular weight 329.04868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,4,4-trifluoro-3-phenyl-3-[(2,2,2-trifluoroacetyl)amino]butanoic acid
Also Known As: 4,4,4-trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid, 4,4,4-trifluoro-3-phenyl-3-[(2,2,2-trifluoroacetyl)amino]butanoic Acid
Technical Specifications
| Molecular Formula | C12H9F6NO3 |
| Molecular Weight | 329.04868 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.04868 Da |
| Heavy Atoms | 22 |
| Complexity | 428.0 |
| SMILES | C1=CC=C(C=C1)C(CC(=O)O)(C(F)(F)F)NC(=O)C(F)(F)F |
| InChIKey | CXLDHBLNXBEZTM-UHFFFAOYSA-N |
Chemical Property Profile of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid
Property Insights of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid. Following Lipinski's Rule of Five, 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid?
The CAS number of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid is 135235-94-8.
What is the molecular formula of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid?
The molecular formula of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid is C12H9F6NO3.
What is the molecular weight of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid?
The molecular weight of 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid is 329.04868 g/mol.
Where can I buy 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid?
You can request a quote for 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4,4,4-Trifluoro-3-phenyl-3-(2,2,2-trifluoroacetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.