Dipropan-2-yl pyridin-4-ylphosphonate
TL;DR: Dipropan-2-yl pyridin-4-ylphosphonate (CAS 58815-96-6) is a chemical compound with molecular formula C11H18NO3P and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-di(propan-2-yloxy)phosphorylpyridine
Also Known As: Dipropan-2-yl pyridin-4-ylphosphonate, 4-di(propan-2-yloxy)phosphorylpyridine, Di(propan-2-yl) pyridin-4-ylphosphonate, Phosphonic acid, bis(1-methylethyl) ester, bis(propan-2-yl) (pyridin-4-yl)phosphonate
| Molecular Formula | C11H18NO3P |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.10243 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 58815-96-6 |
|---|---|
| SMILES | CC(C)OP(=O)(C1=CC=NC=C1)OC(C)C |
| InChIKey | FKMZXWZCEXHILQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dipropan-2-yl pyridin-4-ylphosphonate (CAS 58815-96-6), with molecular formula C11H18NO3P and molecular weight 243.10 g/mol. IUPAC: 4-di(propan-2-yloxy)phosphorylpyridine.
Chemical Property Profile of Dipropan-2-yl pyridin-4-ylphosphonate
Property Insights of Dipropan-2-yl pyridin-4-ylphosphonate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dipropan-2-yl pyridin-4-ylphosphonate. With a topological polar surface area (TPSA) of 48.4 Ų, Dipropan-2-yl pyridin-4-ylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dipropan-2-yl pyridin-4-ylphosphonate 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 Dipropan-2-yl pyridin-4-ylphosphonate?
The CAS number of Dipropan-2-yl pyridin-4-ylphosphonate is 58815-96-6.
What is the molecular formula of Dipropan-2-yl pyridin-4-ylphosphonate?
The molecular formula of Dipropan-2-yl pyridin-4-ylphosphonate is C11H18NO3P.
What is the molecular weight of Dipropan-2-yl pyridin-4-ylphosphonate?
The molecular weight of Dipropan-2-yl pyridin-4-ylphosphonate is 243.10 g/mol.
Where can I buy Dipropan-2-yl pyridin-4-ylphosphonate?
You can request a quote for Dipropan-2-yl pyridin-4-ylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropan-2-yl pyridin-4-ylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dipropan-2-yl pyridin-4-ylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.