5H-Tetrazole, 5-(1,1-dimethylpropyl)-
TL;DR: 5H-Tetrazole, 5-(1,1-dimethylpropyl)- (CAS 86842-35-5) is a chemical compound with molecular formula C6H12N4 and molecular weight 140.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-methylbutan-2-yl)-2H-tetrazole
Also Known As: 5-(1,1-Dimethylpropyl)-5H-tetrazole, 5H-Tetrazole, 5-(1,1-dimethylpropyl)-, 5-(2-methylbutan-2-yl)-2H-tetrazole, RefChem:305838
| Molecular Formula | C6H12N4 |
|---|---|
| Molecular Weight | 140.11 g/mol |
| LogP | 0.8873 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.1062 |
| Heavy Atoms | 10 |
| Complexity | 189.52255 |
Chemical Identifiers
| CAS Number | 86842-35-5 |
|---|---|
| SMILES | CCC(C)(C)C1=NNN=N1 |
Product Overview
5H-Tetrazole, 5-(1,1-dimethylpropyl)- (CAS 86842-35-5), with molecular formula C6H12N4 and molecular weight 140.11 g/mol. IUPAC: 5-(2-methylbutan-2-yl)-2H-tetrazole.
Chemical Property Profile of 5H-Tetrazole, 5-(1,1-dimethylpropyl)-
Property Insights of 5H-Tetrazole, 5-(1,1-dimethylpropyl)-
The XLogP value of 0.8873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Tetrazole, 5-(1,1-dimethylpropyl)-. With a topological polar surface area (TPSA) of 54.46 Ų, 5H-Tetrazole, 5-(1,1-dimethylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Tetrazole, 5-(1,1-dimethylpropyl)- has 1 hydrogen bond donor(s) and 3 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 5H-Tetrazole, 5-(1,1-dimethylpropyl)-?
The CAS number of 5H-Tetrazole, 5-(1,1-dimethylpropyl)- is 86842-35-5.
What is the molecular formula of 5H-Tetrazole, 5-(1,1-dimethylpropyl)-?
The molecular formula of 5H-Tetrazole, 5-(1,1-dimethylpropyl)- is C6H12N4.
What is the molecular weight of 5H-Tetrazole, 5-(1,1-dimethylpropyl)-?
The molecular weight of 5H-Tetrazole, 5-(1,1-dimethylpropyl)- is 140.11 g/mol.
Where can I buy 5H-Tetrazole, 5-(1,1-dimethylpropyl)-?
You can request a quote for 5H-Tetrazole, 5-(1,1-dimethylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Tetrazole, 5-(1,1-dimethylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Tetrazole, 5-(1,1-dimethylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.