4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether
TL;DR: 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether (CAS 4612-90-2) is a chemical compound with molecular formula C8H8N4O and molecular weight 176.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylphenoxy)-2H-tetrazole
Also Known As: 5-(4-methylphenoxy)-2H-tetrazole, 5-(p-tolyloxy)-1H-tetrazole, 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether, 5-(4-Methylphenoxy)-1H-tetrazole, 1H-Tetrazole, 5-(4-methylphenoxy)-
| Molecular Formula | C8H8N4O |
|---|---|
| Molecular Weight | 176.07 g/mol |
| LogP | 1.30042 |
| Topological Polar Surface Area | 63.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.06981 |
| Heavy Atoms | 13 |
| Complexity | 367.55237 |
Chemical Identifiers
| CAS Number | 4612-90-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=NNN=N2 |
Product Overview
4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether (CAS 4612-90-2), with molecular formula C8H8N4O and molecular weight 176.07 g/mol. IUPAC: 5-(4-methylphenoxy)-2H-tetrazole.
Chemical Property Profile of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether
Property Insights of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether
The XLogP value of 1.30042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether. The TPSA of 63.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether. Following Lipinski's Rule of Five, 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether has 1 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-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether?
The CAS number of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether is 4612-90-2.
What is the molecular formula of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether?
The molecular formula of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether is C8H8N4O.
What is the molecular weight of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether?
The molecular weight of 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether is 176.07 g/mol.
Where can I buy 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether?
You can request a quote for 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether?
Yes, KEHONG BIO provides custom synthesis services for 4-methylphenyl 1H-1,2,3,4-tetraazol-5-yl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.