5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)
TL;DR: 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) (CAS 3544-13-6) is a chemical compound with molecular formula C8H6N8 and molecular weight 214.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3-(2H-tetrazol-5-yl)phenyl]-2H-tetrazole
Also Known As: m-bis(tetrazol-5-yl)benzene, 1,3-bis(tetrazol-5-yl)benzene, 1,3-di(2H-tetrazol-5-yl)benzene, 1,3-Bis(1H-tetrazole-5-yl)benzene, 5-[3-(2H-tetrazol-5-yl)phenyl]-2H-tetrazole
| Molecular Formula | C8H6N8 |
|---|---|
| Molecular Weight | 214.07 g/mol |
| LogP | 0.0468 |
| Topological Polar Surface Area | 108.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.07155 |
| Heavy Atoms | 16 |
| Complexity | 520.3812 |
Chemical Identifiers
| CAS Number | 3544-13-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C2=NNN=N2)C3=NNN=N3 |
Product Overview
5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) (CAS 3544-13-6), with molecular formula C8H6N8 and molecular weight 214.07 g/mol. IUPAC: 5-[3-(2H-tetrazol-5-yl)phenyl]-2H-tetrazole.
Chemical Property Profile of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)
Property Insights of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)
The XLogP value of 0.0468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole). The TPSA of 108.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole). Following Lipinski's Rule of Five, 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) has 2 hydrogen bond donor(s) and 6 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 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)?
The CAS number of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) is 3544-13-6.
What is the molecular formula of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)?
The molecular formula of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) is C8H6N8.
What is the molecular weight of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)?
The molecular weight of 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) is 214.07 g/mol.
Where can I buy 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)?
You can request a quote for 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole)?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-(1,3-Phenylene)bis(1H-1,2,3,4-tetrazole) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.