2,3,5,6-Tetrafluorotoluene
TL;DR: 2,3,5,6-Tetrafluorotoluene (CAS 5230-78-4) is a chemical compound with molecular formula C7H4F4 and molecular weight 164.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5-tetrafluoro-3-methylbenzene
Also Known As: 2,3,5,6-Tetrafluorotoluene, 1,2,4,5-Tetrafluoro-3-methylbenzene, null, N,N-Diethylbutylamine, Benzene, 1,2,4,5-tetrafluoro-3-methyl-
| Molecular Formula | C7H4F4 |
|---|---|
| Molecular Weight | 164.02 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.02492 |
| Heavy Atoms | 11 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 5230-78-4 |
|---|---|
| SMILES | CC1=C(C(=CC(=C1F)F)F)F |
| InChIKey | POMGTQLCZJZYAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,5,6-Tetrafluorotoluene (CAS 5230-78-4), with molecular formula C7H4F4 and molecular weight 164.02 g/mol. IUPAC: 1,2,4,5-tetrafluoro-3-methylbenzene.
Chemical Property Profile of 2,3,5,6-Tetrafluorotoluene
Property Insights of 2,3,5,6-Tetrafluorotoluene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,5,6-Tetrafluorotoluene. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,5,6-Tetrafluorotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5,6-Tetrafluorotoluene has 0 hydrogen bond donor(s) and 4 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 2,3,5,6-Tetrafluorotoluene?
The CAS number of 2,3,5,6-Tetrafluorotoluene is 5230-78-4.
What is the molecular formula of 2,3,5,6-Tetrafluorotoluene?
The molecular formula of 2,3,5,6-Tetrafluorotoluene is C7H4F4.
What is the molecular weight of 2,3,5,6-Tetrafluorotoluene?
The molecular weight of 2,3,5,6-Tetrafluorotoluene is 164.02 g/mol.
Where can I buy 2,3,5,6-Tetrafluorotoluene?
You can request a quote for 2,3,5,6-Tetrafluorotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5,6-Tetrafluorotoluene?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5,6-Tetrafluorotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.