N-叔丁氧羰基-4-哌啶酮
TL;DR: N-叔丁氧羰基-4-哌啶酮 (CAS 4230-26-6) is a chemical compound with molecular formula C10H17NO3 and molecular weight 199.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-叔丁氧羰基-4-哌啶酮
tert-butyl 4-oxopiperidine-1-carboxylate
Also Known As: 1-Boc-4-piperidone, N-Boc-4-piperidone, tert-Butyl 4-Oxopiperidine-1-carboxylate, n-(tert-butoxycarbonyl)-4-piperidone, 1-Boc-4-piperidinone
| Molecular Formula | C10H17NO3 |
|---|---|
| Molecular Weight | 199.12 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.12085 |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 4230-26-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(=O)CC1 |
| InChIKey | ROUYFJUVMYHXFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-叔丁氧羰基-4-哌啶酮 (CAS 4230-26-6), with molecular formula C10H17NO3 and molecular weight 199.12 g/mol. IUPAC: tert-butyl 4-oxopiperidine-1-carboxylate.
Chemical Property Profile of N-叔丁氧羰基-4-哌啶酮
Property Insights of N-叔丁氧羰基-4-哌啶酮
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-叔丁氧羰基-4-哌啶酮. With a topological polar surface area (TPSA) of 46.6 Ų, N-叔丁氧羰基-4-哌啶酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-叔丁氧羰基-4-哌啶酮 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
Frequently Asked Questions
What is the CAS number of N-叔丁氧羰基-4-哌啶酮?
The CAS number of N-叔丁氧羰基-4-哌啶酮 is 4230-26-6.
What is the molecular formula of N-叔丁氧羰基-4-哌啶酮?
The molecular formula of N-叔丁氧羰基-4-哌啶酮 is C10H17NO3.
What is the molecular weight of N-叔丁氧羰基-4-哌啶酮?
The molecular weight of N-叔丁氧羰基-4-哌啶酮 is 199.12 g/mol.
Where can I buy N-叔丁氧羰基-4-哌啶酮?
You can request a quote for N-叔丁氧羰基-4-哌啶酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-叔丁氧羰基-4-哌啶酮?
Yes, KEHONG BIO provides custom synthesis services for N-叔丁氧羰基-4-哌啶酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.