Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate
TL;DR: Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate (CAS 55536-75-9) is a chemical compound with molecular formula C17H25NO4 and molecular weight 307.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ditert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate
Also Known As: starbld0007627, Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate, 3,5-DI-TERT-BUTYL 2,6-DIMETHYLPYRIDINE-3,5-DICARBOXYLATE, Ditert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate, J1.862.331E
| Molecular Formula | C17H25NO4 |
|---|---|
| Molecular Weight | 307.18 g/mol |
| LogP | 3.60904 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.17834 |
| Heavy Atoms | 22 |
| Complexity | 542.6521 |
Chemical Identifiers
| CAS Number | 55536-75-9 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C |
Product Overview
Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate (CAS 55536-75-9), with molecular formula C17H25NO4 and molecular weight 307.18 g/mol. IUPAC: ditert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate.
Chemical Property Profile of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate
Property Insights of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate
The XLogP value of 3.60904 indicates that Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate. Following Lipinski's Rule of Five, Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate 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 Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate?
The CAS number of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate is 55536-75-9.
What is the molecular formula of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate?
The molecular formula of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate is C17H25NO4.
What is the molecular weight of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate?
The molecular weight of Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate is 307.18 g/mol.
Where can I buy Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate?
You can request a quote for Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Di-tert-butyl 2,6-dimethylpyridine-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.