1-((2-Chloro-4-fluorophenyl)methyl)piperazine
TL;DR: 1-((2-Chloro-4-fluorophenyl)methyl)piperazine (CAS 1158376-58-9) is a chemical compound with molecular formula C11H14ClFN2 and molecular weight 228.08295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-chloro-4-fluorophenyl)methyl]piperazine
Also Known As: 1-(2-chloro-4-fluorobenzyl)piperazine, 1-[(2-chloro-4-fluorophenyl)methyl]piperazine, 1-(2-chloro-4-fluoro-benzyl)-piperazine, 1-(2-chloro-4-fluorobenzyl)-piperazine, 0579AD
Technical Specifications
| Molecular Formula | C11H14ClFN2 |
| Molecular Weight | 228.08295 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.08295 Da |
| Heavy Atoms | 15 |
| Complexity | 197.0 |
| SMILES | C1CN(CCN1)CC2=C(C=C(C=C2)F)Cl |
| InChIKey | WWHXLQXVHUCVRZ-UHFFFAOYSA-N |
Chemical Property Profile of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine
Property Insights of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2-Chloro-4-fluorophenyl)methyl)piperazine. With a topological polar surface area (TPSA) of 15.3 Ų, 1-((2-Chloro-4-fluorophenyl)methyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((2-Chloro-4-fluorophenyl)methyl)piperazine has 1 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 1-((2-Chloro-4-fluorophenyl)methyl)piperazine?
The CAS number of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine is 1158376-58-9.
What is the molecular formula of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine?
The molecular formula of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine is C11H14ClFN2.
What is the molecular weight of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine?
The molecular weight of 1-((2-Chloro-4-fluorophenyl)methyl)piperazine is 228.08295 g/mol.
Where can I buy 1-((2-Chloro-4-fluorophenyl)methyl)piperazine?
You can request a quote for 1-((2-Chloro-4-fluorophenyl)methyl)piperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((2-Chloro-4-fluorophenyl)methyl)piperazine?
Yes, CoreyChem provides custom synthesis services for 1-((2-Chloro-4-fluorophenyl)methyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.