((3-Trifluoromethyl)phenyl)methyl-phosphonic acid
TL;DR: ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid (CAS 146780-09-8) is a chemical compound with molecular formula C8H8F3O3P and molecular weight 240.01631 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(trifluoromethyl)phenyl]methylphosphonic acid
Also Known As: {[3-(Trifluoromethyl)phenyl]methyl}phosphonic acid, ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid, 3-CF3BPA, [3-(trifluoromethyl)phenyl]methylphosphonic Acid, 3-Trifluoromethylbenzylphosphonic acid
Technical Specifications
| Molecular Formula | C8H8F3O3P |
| Molecular Weight | 240.01631 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.01631 Da |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)CP(=O)(O)O |
| InChIKey | TVXYXFHWFHNWTJ-UHFFFAOYSA-N |
Chemical Property Profile of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid
Property Insights of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid. With a topological polar surface area (TPSA) of 57.5 Ų, ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid 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-Trifluoromethyl)phenyl)methyl-phosphonic acid?
The CAS number of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid is 146780-09-8.
What is the molecular formula of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid?
The molecular formula of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid is C8H8F3O3P.
What is the molecular weight of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid?
The molecular weight of ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid is 240.01631 g/mol.
Where can I buy ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid?
You can request a quote for ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid?
Yes, CoreyChem provides custom synthesis services for ((3-Trifluoromethyl)phenyl)methyl-phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.