2,4,5-Trifluoro-3-methoxybenzamide
TL;DR: 2,4,5-Trifluoro-3-methoxybenzamide (CAS 112811-64-0) is a chemical compound with molecular formula C8H6F3NO2 and molecular weight 205.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,5-trifluoro-3-methoxybenzamide
Also Known As: 2,4,5-trifluoro-3-methoxybenzamide, 3-Methoxy-2,4,5-trifluorobenzamide, Benzamide, 2,4,5-trifluoro-3-methoxy-, 2,4,5-trifluoro-3-methoxy-benzamide
Technical Specifications
| Molecular Formula | C8H6F3NO2 |
| Molecular Weight | 205.03506 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.03506 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | COC1=C(C(=CC(=C1F)F)C(=O)N)F |
| InChIKey | VRGBBPYUJDPXBB-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,5-Trifluoro-3-methoxybenzamide
Property Insights of 2,4,5-Trifluoro-3-methoxybenzamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,5-Trifluoro-3-methoxybenzamide. With a topological polar surface area (TPSA) of 52.3 Ų, 2,4,5-Trifluoro-3-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trifluoro-3-methoxybenzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,4,5-Trifluoro-3-methoxybenzamide?
The CAS number of 2,4,5-Trifluoro-3-methoxybenzamide is 112811-64-0.
What is the molecular formula of 2,4,5-Trifluoro-3-methoxybenzamide?
The molecular formula of 2,4,5-Trifluoro-3-methoxybenzamide is C8H6F3NO2.
What is the molecular weight of 2,4,5-Trifluoro-3-methoxybenzamide?
The molecular weight of 2,4,5-Trifluoro-3-methoxybenzamide is 205.03506 g/mol.
Where can I buy 2,4,5-Trifluoro-3-methoxybenzamide?
You can request a quote for 2,4,5-Trifluoro-3-methoxybenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,5-Trifluoro-3-methoxybenzamide?
Yes, CoreyChem provides custom synthesis services for 2,4,5-Trifluoro-3-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.