p-Tolylazoxycyanide
TL;DR: p-Tolylazoxycyanide (CAS 54797-21-6) is a chemical compound with molecular formula C8H7N3O and molecular weight 161.05891 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyanoimino-(4-methylphenyl)-oxidoazanium
Also Known As: p-Tolylazoxycyanide, p-Tolylazohycyanide, 4-(Cyano-NNO-azoxy)toluene, TOLYLAZOXYCYANIDE, P-, cyanoimino-(4-methylphenyl)-oxidoazanium
Technical Specifications
| Molecular Formula | C8H7N3O |
| Molecular Weight | 161.05891 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.05891 Da |
| Heavy Atoms | 12 |
| Complexity | 220.0 |
| SMILES | CC1=CC=C(C=C1)[N+](=NC#N)[O-] |
| InChIKey | JDUNJHINICKBSP-UHFFFAOYSA-N |
Chemical Property Profile of p-Tolylazoxycyanide
Property Insights of p-Tolylazoxycyanide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Tolylazoxycyanide. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Tolylazoxycyanide. Following Lipinski's Rule of Five, p-Tolylazoxycyanide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of p-Tolylazoxycyanide?
The CAS number of p-Tolylazoxycyanide is 54797-21-6.
What is the molecular formula of p-Tolylazoxycyanide?
The molecular formula of p-Tolylazoxycyanide is C8H7N3O.
What is the molecular weight of p-Tolylazoxycyanide?
The molecular weight of p-Tolylazoxycyanide is 161.05891 g/mol.
Where can I buy p-Tolylazoxycyanide?
You can request a quote for p-Tolylazoxycyanide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-Tolylazoxycyanide?
Yes, CoreyChem provides custom synthesis services for p-Tolylazoxycyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.