1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine
TL;DR: 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine (CAS 694501-34-3) is a chemical compound with molecular formula C12H16FN3O2 and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-4-(2-fluoro-4-nitrophenyl)piperazine
Also Known As: 1-ethyl-4-(2-fluoro-4-nitrophenyl)piperazine, Piperazine, 1-ethyl-4-(2-fluoro-4-nitrophenyl)-, 1-ethyl-4-(2-fluoro-4-nitro-phenyl)-piperazine, 1-ethyl-4-(2-fluoro-4-nitro-phenyl)piperazine, Piperazine,1-ethyl-4-(2-fluoro-4-nitrophenyl)-
| Molecular Formula | C12H16FN3O2 |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 1.8758 |
| Topological Polar Surface Area | 49.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.12265 |
| Heavy Atoms | 18 |
| Complexity | 444.9487 |
Chemical Identifiers
| CAS Number | 694501-34-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])F |
Product Overview
1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine (CAS 694501-34-3), with molecular formula C12H16FN3O2 and molecular weight 253.12 g/mol. IUPAC: 1-ethyl-4-(2-fluoro-4-nitrophenyl)piperazine.
Chemical Property Profile of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine
Property Insights of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine
The XLogP value of 1.8758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine. With a topological polar surface area (TPSA) of 49.62 Ų, 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine?
The CAS number of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine is 694501-34-3.
What is the molecular formula of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine?
The molecular formula of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine is C12H16FN3O2.
What is the molecular weight of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine?
The molecular weight of 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine is 253.12 g/mol.
Where can I buy 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine?
You can request a quote for 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-4-(2-fluoro-4-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.