Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate
TL;DR: Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate (CAS 690632-03-2) is a chemical compound with molecular formula C16H22N2O5 and molecular weight 322.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate
Also Known As: tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate, Spiro[5.6]dodec-1-en-3-one, BUTTPARK 99\57-82, TERT-BUTYL 4-(2-NITROPHENOXY)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE, 4-(2-Nitrophenoxy)piperidine, N-BOC protected
| Molecular Formula | C16H22N2O5 |
|---|---|
| Molecular Weight | 322.15 g/mol |
| LogP | 3.3731 |
| Topological Polar Surface Area | 81.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.15286 |
| Heavy Atoms | 23 |
| Complexity | 574.0785 |
Chemical Identifiers
| CAS Number | 690632-03-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=CC=C2[N+](=O)[O-] |
Product Overview
Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate (CAS 690632-03-2), with molecular formula C16H22N2O5 and molecular weight 322.15 g/mol. IUPAC: tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate.
Chemical Property Profile of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate
Property Insights of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate
The XLogP value of 3.3731 indicates that Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate. Following Lipinski's Rule of Five, Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate 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
Frequently Asked Questions
What is the CAS number of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate?
The CAS number of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate is 690632-03-2.
What is the molecular formula of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate?
The molecular formula of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate is C16H22N2O5.
What is the molecular weight of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate?
The molecular weight of Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate is 322.15 g/mol.
Where can I buy Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate?
You can request a quote for Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 4-(2-nitrophenoxy)piperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.