5-Butoxy-1-(4-nitrophenyl)tetrazole
TL;DR: 5-Butoxy-1-(4-nitrophenyl)tetrazole (CAS 291535-00-7) is a chemical compound with molecular formula C11H13N5O3 and molecular weight 263.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butoxy-1-(4-nitrophenyl)tetrazole
Also Known As: 5-butoxy-1-(4-nitrophenyl)tetrazole, 5-butoxy-1-{4-nitrophenyl}-1H-tetraazole, AL-291/13466007
| Molecular Formula | C11H13N5O3 |
|---|---|
| Molecular Weight | 263.10 g/mol |
| LogP | 1.7494 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 263.10184 |
| Heavy Atoms | 19 |
| Complexity | 551.71326 |
Chemical Identifiers
| CAS Number | 291535-00-7 |
|---|---|
| SMILES | CCCCOC1=NN=NN1C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
5-Butoxy-1-(4-nitrophenyl)tetrazole (CAS 291535-00-7), with molecular formula C11H13N5O3 and molecular weight 263.10 g/mol. IUPAC: 5-butoxy-1-(4-nitrophenyl)tetrazole.
Chemical Property Profile of 5-Butoxy-1-(4-nitrophenyl)tetrazole
Property Insights of 5-Butoxy-1-(4-nitrophenyl)tetrazole
The XLogP value of 1.7494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Butoxy-1-(4-nitrophenyl)tetrazole. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Butoxy-1-(4-nitrophenyl)tetrazole. Following Lipinski's Rule of Five, 5-Butoxy-1-(4-nitrophenyl)tetrazole has 0 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-Butoxy-1-(4-nitrophenyl)tetrazole?
The CAS number of 5-Butoxy-1-(4-nitrophenyl)tetrazole is 291535-00-7.
What is the molecular formula of 5-Butoxy-1-(4-nitrophenyl)tetrazole?
The molecular formula of 5-Butoxy-1-(4-nitrophenyl)tetrazole is C11H13N5O3.
What is the molecular weight of 5-Butoxy-1-(4-nitrophenyl)tetrazole?
The molecular weight of 5-Butoxy-1-(4-nitrophenyl)tetrazole is 263.10 g/mol.
Where can I buy 5-Butoxy-1-(4-nitrophenyl)tetrazole?
You can request a quote for 5-Butoxy-1-(4-nitrophenyl)tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Butoxy-1-(4-nitrophenyl)tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Butoxy-1-(4-nitrophenyl)tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.