1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine
TL;DR: 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine (CAS 141699-59-4) is a chemical compound with molecular formula C11H21NO5S and molecular weight 279.11404 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 4-methylsulfonyloxypiperidine-1-carboxylate
Also Known As: 1-Boc-4-methanesulfonyloxypiperidine, tert-Butyl 4-((methylsulfonyl)oxy)piperidine-1-carboxylate, 1-Boc-4-methanesulfonyloxy-piperidine, N-Boc-4-mesyloxypiperidine, Ibrutinib Impurity A
Technical Specifications
| Molecular Formula | C11H21NO5S |
| Molecular Weight | 279.11404 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 81.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.11404 Da |
| Heavy Atoms | 18 |
| Complexity | 385.0 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)OS(=O)(=O)C |
| InChIKey | WOEQSXAIPTXOPY-UHFFFAOYSA-N |
Chemical Property Profile of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine
Property Insights of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine. Following Lipinski's Rule of Five, 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine has 0 hydrogen bond donor(s) and 5 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-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine?
The CAS number of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine is 141699-59-4.
What is the molecular formula of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine?
The molecular formula of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine is C11H21NO5S.
What is the molecular weight of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine?
The molecular weight of 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine is 279.11404 g/mol.
Where can I buy 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine?
You can request a quote for 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine?
Yes, CoreyChem provides custom synthesis services for 1-(tert-Butoxycarbonyl)-4-(methanesulfonyloxy)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.