1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene
TL;DR: 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene (CAS 136820-95-6) is a chemical compound with molecular formula C7HF7 and molecular weight 217.99664 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4-tetrafluoro-5-(trifluoromethyl)benzene
Also Known As: 2,3,4,5-TETRAFLUOROBENZOTRIFLUORIDE, 1,2,3,4-tetrafluoro-5-(trifluoromethyl)benzene, 2H-Heptafluorotoluene, 2,3,4,5-tetrafluoro-benzotrifluoride, Benzene, tetrafluoro(trifluoromethyl)-
Technical Specifications
| Molecular Formula | C7HF7 |
| Molecular Weight | 217.99664 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.99664 Da |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
| SMILES | C1=C(C(=C(C(=C1F)F)F)F)C(F)(F)F |
| InChIKey | ZWVOHERGWLDGFT-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene
Property Insights of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene
The XLogP value of 3.2 indicates that 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene?
The CAS number of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene is 136820-95-6.
What is the molecular formula of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene?
The molecular formula of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene is C7HF7.
What is the molecular weight of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene?
The molecular weight of 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene is 217.99664 g/mol.
Where can I buy 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene?
You can request a quote for 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.