![4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) structure](/static/products/5038/50381-90-3.webp)
4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)
TL;DR: 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) (CAS 50381-90-3) is a chemical compound with molecular formula C19H16I2N2O2 and molecular weight 557.9301 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[5-(4-cyano-2-iodophenoxy)pentoxy]-3-iodobenzonitrile
Also Known As: 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile), 4-[5-(4-cyano-2-iodophenoxy)pentoxy]-3-iodobenzonitrile
Technical Specifications
| Molecular Formula | C19H16I2N2O2 |
| Molecular Weight | 557.9301 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 557.9301 Da |
| Heavy Atoms | 25 |
| Complexity | 454.0 |
| SMILES | C1=CC(=C(C=C1C#N)I)OCCCCCOC2=C(C=C(C=C2)C#N)I |
| InChIKey | LZPCAOORVVSZNK-UHFFFAOYSA-N |
Chemical Property Profile of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)
Property Insights of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)
The XLogP value of 5.4 indicates that 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile). Following Lipinski's Rule of Five, 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)?
The CAS number of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) is 50381-90-3.
What is the molecular formula of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)?
The molecular formula of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) is C19H16I2N2O2.
What is the molecular weight of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)?
The molecular weight of 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) is 557.9301 g/mol.
Where can I buy 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)?
You can request a quote for 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile)?
Yes, CoreyChem provides custom synthesis services for 4,4'-[Pentane-1,5-diylbis(oxy)]bis(3-iodobenzonitrile) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.