3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride
TL;DR: 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride (CAS 109919-26-8) is a chemical compound with molecular formula C8H2Cl2F4O and molecular weight 259.9419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride
Also Known As: 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride, 3-chloro-2-fluoro-5-trifluoromethylbenzoyl chloride, Benzoyl chloride, 3-chloro-2-fluoro-5-(trifluoromethyl)-, 2-Bromo-6-chloro-4-(trifluoromethyl)aniline, 3-CHLORO-2-FLUORO-5- BENZOYLCHLORIDE
Technical Specifications
| Molecular Formula | C8H2Cl2F4O |
| Molecular Weight | 259.9419 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.9419 Da |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
| SMILES | C1=C(C=C(C(=C1C(=O)Cl)F)Cl)C(F)(F)F |
| InChIKey | WWXKIEVIKMYSCL-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride
Property Insights of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride
The XLogP value of 4.0 indicates that 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride?
The CAS number of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride is 109919-26-8.
What is the molecular formula of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride?
The molecular formula of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride is C8H2Cl2F4O.
What is the molecular weight of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride?
The molecular weight of 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride is 259.9419 g/mol.
Where can I buy 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride?
You can request a quote for 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-Chloro-2-fluoro-5-(trifluoromethyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.