4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile
TL;DR: 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile (CAS 93485-73-5) is a chemical compound with molecular formula C13H7N3O and molecular weight 221.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pyridin-3-yloxybenzene-1,2-dicarbonitrile
Also Known As: 4-(3-pyridinyloxy)phthalonitrile, 4-pyridin-3-yloxybenzene-1,2-dicarbonitrile, 4-(Pyridin-3-yloxy)-phthalonitrile, 4-(3-pyridyloxy)phthalonitrile, 4-pyrid-3-yloxyphthalonitrile
| Molecular Formula | C13H7N3O |
|---|---|
| Molecular Weight | 221.06 g/mol |
| LogP | 2.61726 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.05891 |
| Heavy Atoms | 17 |
| Complexity | 608.79706 |
Chemical Identifiers
| CAS Number | 93485-73-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)OC2=CC(=C(C=C2)C#N)C#N |
Product Overview
4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile (CAS 93485-73-5), with molecular formula C13H7N3O and molecular weight 221.06 g/mol. IUPAC: 4-pyridin-3-yloxybenzene-1,2-dicarbonitrile.
Chemical Property Profile of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile
Property Insights of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile
The XLogP value of 2.61726 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile. Following Lipinski's Rule of Five, 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile 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 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile?
The CAS number of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile is 93485-73-5.
What is the molecular formula of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile?
The molecular formula of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile is C13H7N3O.
What is the molecular weight of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile?
The molecular weight of 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile is 221.06 g/mol.
Where can I buy 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile?
You can request a quote for 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridin-3-yloxybenzene-1,2-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.