5H-Tetrazole, 5-(1-propylbutyl)-
TL;DR: 5H-Tetrazole, 5-(1-propylbutyl)- (CAS 85508-57-2) is a chemical compound with molecular formula C8H16N4 and molecular weight 168.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-heptan-4-yl-2H-tetrazole
Also Known As: 5-(4-Heptyl)tetrazole, 5-heptan-4-yl-2H-tetrazole, 5-(Hept-4-yl)-2H-tetrazole, 5H-Tetrazole, 5-(1-propylbutyl)-, 5-(1-Propylbutyl)-5H-tetrazole
| Molecular Formula | C8H16N4 |
|---|---|
| Molecular Weight | 168.14 g/mol |
| LogP | 1.8835 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.1375 |
| Heavy Atoms | 12 |
| Complexity | 188.8326 |
Chemical Identifiers
| CAS Number | 85508-57-2 |
|---|---|
| SMILES | CCCC(CCC)C1=NNN=N1 |
Product Overview
5H-Tetrazole, 5-(1-propylbutyl)- (CAS 85508-57-2), with molecular formula C8H16N4 and molecular weight 168.14 g/mol. IUPAC: 5-heptan-4-yl-2H-tetrazole.
Chemical Property Profile of 5H-Tetrazole, 5-(1-propylbutyl)-
Property Insights of 5H-Tetrazole, 5-(1-propylbutyl)-
The XLogP value of 1.8835 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Tetrazole, 5-(1-propylbutyl)-. With a topological polar surface area (TPSA) of 54.46 Ų, 5H-Tetrazole, 5-(1-propylbutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Tetrazole, 5-(1-propylbutyl)- 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-propylbutyl)-?
The CAS number of 5H-Tetrazole, 5-(1-propylbutyl)- is 85508-57-2.
What is the molecular formula of 5H-Tetrazole, 5-(1-propylbutyl)-?
The molecular formula of 5H-Tetrazole, 5-(1-propylbutyl)- is C8H16N4.
What is the molecular weight of 5H-Tetrazole, 5-(1-propylbutyl)-?
The molecular weight of 5H-Tetrazole, 5-(1-propylbutyl)- is 168.14 g/mol.
Where can I buy 5H-Tetrazole, 5-(1-propylbutyl)-?
You can request a quote for 5H-Tetrazole, 5-(1-propylbutyl)- 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-propylbutyl)-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Tetrazole, 5-(1-propylbutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.