2,3-Difluoro-4-(trifluoromethyl)phenol
TL;DR: 2,3-Difluoro-4-(trifluoromethyl)phenol (CAS 116640-12-1) is a chemical compound with molecular formula C7H3F5O and molecular weight 198.0104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-difluoro-4-(trifluoromethyl)phenol
Also Known As: 2,3-difluoro-4-(trifluoromethyl)phenol, 2,3-Difluoro-4-hydroxybenzotrifluoride, Phenol,2,3-difluoro-4-(trifluoromethyl)-, Phenol, 2,3-difluoro-4-(trifluoromethyl)-, Phenol,2,3-difluoro-4-(trifluoromethyl)
Technical Specifications
| Molecular Formula | C7H3F5O |
| Molecular Weight | 198.0104 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.0104 Da |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
| SMILES | C1=CC(=C(C(=C1C(F)(F)F)F)F)O |
| InChIKey | WWJVQVQWMHTPNE-UHFFFAOYSA-N |
Chemical Property Profile of 2,3-Difluoro-4-(trifluoromethyl)phenol
Property Insights of 2,3-Difluoro-4-(trifluoromethyl)phenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Difluoro-4-(trifluoromethyl)phenol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,3-Difluoro-4-(trifluoromethyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Difluoro-4-(trifluoromethyl)phenol 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 2,3-Difluoro-4-(trifluoromethyl)phenol?
The CAS number of 2,3-Difluoro-4-(trifluoromethyl)phenol is 116640-12-1.
What is the molecular formula of 2,3-Difluoro-4-(trifluoromethyl)phenol?
The molecular formula of 2,3-Difluoro-4-(trifluoromethyl)phenol is C7H3F5O.
What is the molecular weight of 2,3-Difluoro-4-(trifluoromethyl)phenol?
The molecular weight of 2,3-Difluoro-4-(trifluoromethyl)phenol is 198.0104 g/mol.
Where can I buy 2,3-Difluoro-4-(trifluoromethyl)phenol?
You can request a quote for 2,3-Difluoro-4-(trifluoromethyl)phenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Difluoro-4-(trifluoromethyl)phenol?
Yes, CoreyChem provides custom synthesis services for 2,3-Difluoro-4-(trifluoromethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.