Tetramethylentetrazol
TL;DR: Tetramethylentetrazol (CAS 13242-31-4) is a chemical compound with molecular formula C6H10N8 and molecular weight 194.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(2H-tetrazol-5-yl)butyl]-2H-tetrazole
Also Known As: Tetramethylentetrazol, 1,4-di(tetrazol-5-yl)butane, 5,5 -Tetramethylenebis(1H-tetrazole), 5,5 -Tetramethylenebis(2H-tetrazole), 5-[4-(2H-tetrazol-5-yl)butyl]-2H-tetrazole
| Molecular Formula | C6H10N8 |
|---|---|
| Molecular Weight | 194.10 g/mol |
| LogP | -0.7218 |
| Topological Polar Surface Area | 108.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.10284 |
| Heavy Atoms | 14 |
| Complexity | 301.5599 |
Chemical Identifiers
| CAS Number | 13242-31-4 |
|---|---|
| SMILES | C(CCC1=NNN=N1)CC2=NNN=N2 |
Product Overview
Tetramethylentetrazol (CAS 13242-31-4), with molecular formula C6H10N8 and molecular weight 194.10 g/mol. IUPAC: 5-[4-(2H-tetrazol-5-yl)butyl]-2H-tetrazole.
Chemical Property Profile of Tetramethylentetrazol
Property Insights of Tetramethylentetrazol
The XLogP value of -0.7218 indicates that Tetramethylentetrazol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetramethylentetrazol. Following Lipinski's Rule of Five, Tetramethylentetrazol 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 Tetramethylentetrazol?
The CAS number of Tetramethylentetrazol is 13242-31-4.
What is the molecular formula of Tetramethylentetrazol?
The molecular formula of Tetramethylentetrazol is C6H10N8.
What is the molecular weight of Tetramethylentetrazol?
The molecular weight of Tetramethylentetrazol is 194.10 g/mol.
Where can I buy Tetramethylentetrazol?
You can request a quote for Tetramethylentetrazol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetramethylentetrazol?
Yes, KEHONG BIO provides custom synthesis services for Tetramethylentetrazol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.