Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-
TL;DR: Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- (CAS 112731-80-3) is a chemical compound with molecular formula C13H16INO3 and molecular weight 361.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-iodo-5-(4-propyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)pyridine
Also Known As: Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-, 2-Iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)pyridine, 1-(6-Iodo-3-pyridyl)-4-n-propyl-2,6,7-trioxabicyclo(2.2.2)ocatane, 1-(6-iodo-3-pyridyl)-4-n-propyl-2,6,7-trioxabicyclo[2.2.2] octane, 2-iodo-5-(1-propyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)pyridine
| Molecular Formula | C13H16INO3 |
|---|---|
| Molecular Weight | 361.02 g/mol |
| LogP | 2.66 |
| Topological Polar Surface Area | 40.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.0175 |
| Heavy Atoms | 18 |
| Complexity | 409.8381 |
Chemical Identifiers
| CAS Number | 112731-80-3 |
|---|---|
| SMILES | CCCC12COC(OC1)(OC2)C3=CN=C(C=C3)I |
Product Overview
Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- (CAS 112731-80-3), with molecular formula C13H16INO3 and molecular weight 361.02 g/mol. IUPAC: 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo[2.2.2]octan-1-yl)pyridine.
Chemical Property Profile of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-
Property Insights of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-
The XLogP value of 2.66 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-. With a topological polar surface area (TPSA) of 40.58 Ų, Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- 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 Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-?
The CAS number of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- is 112731-80-3.
What is the molecular formula of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-?
The molecular formula of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- is C13H16INO3.
What is the molecular weight of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-?
The molecular weight of Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- is 361.02 g/mol.
Where can I buy Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-?
You can request a quote for Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyridine, 2-iodo-5-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.