2-Fluoro-5-(trifluoromethyl)phenol
TL;DR: 2-Fluoro-5-(trifluoromethyl)phenol (CAS 3526-27-0) is a chemical compound with molecular formula C7H4F4O and molecular weight 180.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-5-(trifluoromethyl)phenol
Also Known As: 2-Fluoro-5-(trifluoromethyl)phenol, 2-fluoro-5-trifluoromethylphenol, BisphenolC, Phenol, 2-fluoro-5-(trifluoromethyl)-, 4-Fluoro-3-hydroxybenzotrifluoride
| Molecular Formula | C7H4F4O |
|---|---|
| Molecular Weight | 180.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.01982 |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 3526-27-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)O)F |
| InChIKey | MCOSBFKOUQAIJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Fluoro-5-(trifluoromethyl)phenol (CAS 3526-27-0), with molecular formula C7H4F4O and molecular weight 180.02 g/mol. IUPAC: 2-fluoro-5-(trifluoromethyl)phenol.
Chemical Property Profile of 2-Fluoro-5-(trifluoromethyl)phenol
Property Insights of 2-Fluoro-5-(trifluoromethyl)phenol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-5-(trifluoromethyl)phenol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Fluoro-5-(trifluoromethyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-5-(trifluoromethyl)phenol 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
Frequently Asked Questions
What is the CAS number of 2-Fluoro-5-(trifluoromethyl)phenol?
The CAS number of 2-Fluoro-5-(trifluoromethyl)phenol is 3526-27-0.
What is the molecular formula of 2-Fluoro-5-(trifluoromethyl)phenol?
The molecular formula of 2-Fluoro-5-(trifluoromethyl)phenol is C7H4F4O.
What is the molecular weight of 2-Fluoro-5-(trifluoromethyl)phenol?
The molecular weight of 2-Fluoro-5-(trifluoromethyl)phenol is 180.02 g/mol.
Where can I buy 2-Fluoro-5-(trifluoromethyl)phenol?
You can request a quote for 2-Fluoro-5-(trifluoromethyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-5-(trifluoromethyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-5-(trifluoromethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.