3,5-吡啶二甲酸二异丙酯
TL;DR: 3,5-吡啶二甲酸二异丙酯 (CAS 3737-22-2) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-吡啶二甲酸二异丙酯
dipropan-2-yl pyridine-3,5-dicarboxylate
Also Known As: Dipropyl isocinchomerate, Diisopropyl pyridine-3,5-dicarboxylate, Dipropyl isocinchomerate [C], 3,5-Pyridinedicarboxylic acid, diisopropyl ester, dipropan-2-yl pyridine-3,5-dicarboxylate
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 3737-22-2 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC(=CN=C1)C(=O)OC(C)C |
| InChIKey | JHKOMVRNWGLUFA-UHFFFAOYSA-N |
Product Overview
3,5-吡啶二甲酸二异丙酯 (CAS 3737-22-2), with molecular formula C13H17NO4 and molecular weight 251.12 g/mol. IUPAC: dipropan-2-yl pyridine-3,5-dicarboxylate.
Chemical Property Profile of 3,5-吡啶二甲酸二异丙酯
Property Insights of 3,5-吡啶二甲酸二异丙酯
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-吡啶二甲酸二异丙酯. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-吡啶二甲酸二异丙酯. Following Lipinski's Rule of Five, 3,5-吡啶二甲酸二异丙酯 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 3,5-吡啶二甲酸二异丙酯?
The CAS number of 3,5-吡啶二甲酸二异丙酯 is 3737-22-2.
What is the molecular formula of 3,5-吡啶二甲酸二异丙酯?
The molecular formula of 3,5-吡啶二甲酸二异丙酯 is C13H17NO4.
What is the molecular weight of 3,5-吡啶二甲酸二异丙酯?
The molecular weight of 3,5-吡啶二甲酸二异丙酯 is 251.12 g/mol.
Where can I buy 3,5-吡啶二甲酸二异丙酯?
You can request a quote for 3,5-吡啶二甲酸二异丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-吡啶二甲酸二异丙酯?
Yes, KEHONG BIO provides custom synthesis services for 3,5-吡啶二甲酸二异丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.