tert-Butyl pyridine-2-carboperoxoate
TL;DR: tert-Butyl pyridine-2-carboperoxoate (CAS 60512-72-3) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl pyridine-2-carboperoxoate
Also Known As: tert-butyl pyridine-2-carboperoxoate, tert-Butyl peroxypicolinate, 2-Pyridinecarboperoxoicacid,1,1-dimethylethylester, 2-Pyridinecarboperoxoicacid, 1,1-dimethylethyl ester, 2-Pyridinecarboperoxoic acid, 1,1-dimethylethyl ester (9CI)
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 60512-72-3 |
|---|---|
| SMILES | CC(C)(C)OOC(=O)C1=CC=CC=N1 |
| InChIKey | KMYPHAMHWAHNJN-UHFFFAOYSA-N |
Product Overview
tert-Butyl pyridine-2-carboperoxoate (CAS 60512-72-3), with molecular formula C10H13NO3 and molecular weight 195.09 g/mol. IUPAC: tert-butyl pyridine-2-carboperoxoate.
Chemical Property Profile of tert-Butyl pyridine-2-carboperoxoate
Property Insights of tert-Butyl pyridine-2-carboperoxoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl pyridine-2-carboperoxoate. With a topological polar surface area (TPSA) of 48.4 Ų, tert-Butyl pyridine-2-carboperoxoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl pyridine-2-carboperoxoate 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 tert-Butyl pyridine-2-carboperoxoate?
The CAS number of tert-Butyl pyridine-2-carboperoxoate is 60512-72-3.
What is the molecular formula of tert-Butyl pyridine-2-carboperoxoate?
The molecular formula of tert-Butyl pyridine-2-carboperoxoate is C10H13NO3.
What is the molecular weight of tert-Butyl pyridine-2-carboperoxoate?
The molecular weight of tert-Butyl pyridine-2-carboperoxoate is 195.09 g/mol.
Where can I buy tert-Butyl pyridine-2-carboperoxoate?
You can request a quote for tert-Butyl pyridine-2-carboperoxoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl pyridine-2-carboperoxoate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl pyridine-2-carboperoxoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.