7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole
TL;DR: 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole (CAS 143708-37-6) is a chemical compound with molecular formula C8H4Cl2FNO and molecular weight 218.9654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-2-(chloromethyl)-4-fluoro-1,3-benzoxazole
Also Known As: 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole, 7-chloro-2-(chloromethyl)-4-fluoro-benzooxazole, 7-chloro-2-(chloromethyl)-4-fluorobenzo[d]oxazole, 7-Chloro-2-(chloromethyl)-4-fluoro-1,3-benzoxazole
Technical Specifications
| Molecular Formula | C8H4Cl2FNO |
| Molecular Weight | 218.9654 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.9654 Da |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
| SMILES | C1=CC(=C2C(=C1F)N=C(O2)CCl)Cl |
| InChIKey | IBJBWAPQYLKCFK-UHFFFAOYSA-N |
Chemical Property Profile of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole
Property Insights of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole. With a topological polar surface area (TPSA) of 26.0 Ų, 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole?
The CAS number of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole is 143708-37-6.
What is the molecular formula of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole?
The molecular formula of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole is C8H4Cl2FNO.
What is the molecular weight of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole?
The molecular weight of 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole is 218.9654 g/mol.
Where can I buy 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole?
You can request a quote for 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole?
Yes, CoreyChem provides custom synthesis services for 7-Chloro-2-(chloromethyl)-4-fluorobenzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.