3,4-Difluorophenol
TL;DR: 3,4-Difluorophenol (CAS 2713-33-9) is a chemical compound with molecular formula C6H4F2O and molecular weight 130.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-difluorophenol
Also Known As: 3,4-Difluorophenol, Phenol, 3,4-difluoro-, 3,4-difluoro phenol, 3,4-difluor-phenol, 3,4-difluoro-phenol
| Molecular Formula | C6H4F2O |
|---|---|
| Molecular Weight | 130.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.02303 |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 2713-33-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)F)F |
| InChIKey | BNPWVUJOPCGHIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Difluorophenol (CAS 2713-33-9), with molecular formula C6H4F2O and molecular weight 130.02 g/mol. IUPAC: 3,4-difluorophenol.
Chemical Property Profile of 3,4-Difluorophenol
Property Insights of 3,4-Difluorophenol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Difluorophenol. With a topological polar surface area (TPSA) of 20.2 Ų, 3,4-Difluorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Difluorophenol has 1 hydrogen bond donor(s) and 3 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 3,4-Difluorophenol?
The CAS number of 3,4-Difluorophenol is 2713-33-9.
What is the molecular formula of 3,4-Difluorophenol?
The molecular formula of 3,4-Difluorophenol is C6H4F2O.
What is the molecular weight of 3,4-Difluorophenol?
The molecular weight of 3,4-Difluorophenol is 130.02 g/mol.
Where can I buy 3,4-Difluorophenol?
You can request a quote for 3,4-Difluorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Difluorophenol?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Difluorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.