4-Chloro-3-fluorobenzoyl chloride
TL;DR: 4-Chloro-3-fluorobenzoyl chloride (CAS 477535-42-5) is a chemical compound with molecular formula C7H3Cl2FO and molecular weight 191.9545 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-3-fluorobenzoyl chloride
Also Known As: 4-Chloro-3-fluorobenzoyl chloride, 3-Fluoro-4-chlorobenzoyl chloride, 4-chloro-3-fluoro-benzoyl Chloride, Benzoyl chloride, 4-chloro-3-fluoro- (9CI), 4-Chloro-3-fluorobenzoylchloride
Technical Specifications
| Molecular Formula | C7H3Cl2FO |
| Molecular Weight | 191.9545 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.9545 Da |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
| SMILES | C1=CC(=C(C=C1C(=O)Cl)F)Cl |
| InChIKey | HJMGUKOEVZJUAO-UHFFFAOYSA-N |
Chemical Property Profile of 4-Chloro-3-fluorobenzoyl chloride
Property Insights of 4-Chloro-3-fluorobenzoyl chloride
The XLogP value of 3.9 indicates that 4-Chloro-3-fluorobenzoyl 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, 4-Chloro-3-fluorobenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3-fluorobenzoyl chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chloro-3-fluorobenzoyl chloride?
The CAS number of 4-Chloro-3-fluorobenzoyl chloride is 477535-42-5.
What is the molecular formula of 4-Chloro-3-fluorobenzoyl chloride?
The molecular formula of 4-Chloro-3-fluorobenzoyl chloride is C7H3Cl2FO.
What is the molecular weight of 4-Chloro-3-fluorobenzoyl chloride?
The molecular weight of 4-Chloro-3-fluorobenzoyl chloride is 191.9545 g/mol.
Where can I buy 4-Chloro-3-fluorobenzoyl chloride?
You can request a quote for 4-Chloro-3-fluorobenzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-3-fluorobenzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-3-fluorobenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.