2,4,5-Trifluoro-3-methoxyaniline
TL;DR: 2,4,5-Trifluoro-3-methoxyaniline (CAS 114214-45-8) is a chemical compound with molecular formula C7H6F3NO and molecular weight 177.04015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4,5-trifluoro-3-methoxyaniline
Also Known As: 2,4,5-trifluoro-3-methoxyaniline, 3-Methoxy-2,4,5-trifluoroaniline, 2,4,5-trifluoro-3-methoxy-aniline, 2,4,5-trifluoro-3-methoxyphenylamine, Benzenamine, 2,4,5-trifluoro-3-methoxy-
Technical Specifications
| Molecular Formula | C7H6F3NO |
| Molecular Weight | 177.04015 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.04015 Da |
| Heavy Atoms | 12 |
| Complexity | 158.0 |
| SMILES | COC1=C(C(=CC(=C1F)F)N)F |
| InChIKey | SESHQEGOVPUXAH-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,5-Trifluoro-3-methoxyaniline
Property Insights of 2,4,5-Trifluoro-3-methoxyaniline
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,5-Trifluoro-3-methoxyaniline. With a topological polar surface area (TPSA) of 35.3 Ų, 2,4,5-Trifluoro-3-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trifluoro-3-methoxyaniline 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-methoxyaniline?
The CAS number of 2,4,5-Trifluoro-3-methoxyaniline is 114214-45-8.
What is the molecular formula of 2,4,5-Trifluoro-3-methoxyaniline?
The molecular formula of 2,4,5-Trifluoro-3-methoxyaniline is C7H6F3NO.
What is the molecular weight of 2,4,5-Trifluoro-3-methoxyaniline?
The molecular weight of 2,4,5-Trifluoro-3-methoxyaniline is 177.04015 g/mol.
Where can I buy 2,4,5-Trifluoro-3-methoxyaniline?
You can request a quote for 2,4,5-Trifluoro-3-methoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,5-Trifluoro-3-methoxyaniline?
Yes, CoreyChem provides custom synthesis services for 2,4,5-Trifluoro-3-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.