Ethyl 4-(butan-2-yl)piperazine-1-carboxylate
TL;DR: Ethyl 4-(butan-2-yl)piperazine-1-carboxylate (CAS 63981-42-0) is a chemical compound with molecular formula C11H22N2O2 and molecular weight 214.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-butan-2-ylpiperazine-1-carboxylate
Also Known As: 1-Carbethoxy-4-sec-butylpiperazine, ethyl 4-butan-2-ylpiperazine-1-carboxylate, ethyl 4-sec-butylpiperazine-1-carboxylate, Ethyl 4-(butan-2-yl)piperazine-1-carboxylate, 1-Piperazinecarboxylic acid, 4-sec-butyl-, ethyl ester
Technical Specifications
| Molecular Formula | C11H22N2O2 |
| Molecular Weight | 214.16812 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 214.16812 Da |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
| SMILES | CCC(C)N1CCN(CC1)C(=O)OCC |
| InChIKey | AYSLABMBEKTPTQ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate
Property Insights of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(butan-2-yl)piperazine-1-carboxylate. With a topological polar surface area (TPSA) of 32.8 Ų, Ethyl 4-(butan-2-yl)piperazine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(butan-2-yl)piperazine-1-carboxylate 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 Ethyl 4-(butan-2-yl)piperazine-1-carboxylate?
The CAS number of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate is 63981-42-0.
What is the molecular formula of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate?
The molecular formula of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate is C11H22N2O2.
What is the molecular weight of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate?
The molecular weight of Ethyl 4-(butan-2-yl)piperazine-1-carboxylate is 214.16812 g/mol.
Where can I buy Ethyl 4-(butan-2-yl)piperazine-1-carboxylate?
You can request a quote for Ethyl 4-(butan-2-yl)piperazine-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 4-(butan-2-yl)piperazine-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 4-(butan-2-yl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.