2-(4-Nitrophenyl)-2H-tetrazole
TL;DR: 2-(4-Nitrophenyl)-2H-tetrazole (CAS 52708-38-0) is a chemical compound with molecular formula C7H5N5O2 and molecular weight 191.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)tetrazole
Also Known As: 2-(4-nitrophenyl)tetrazole, 2-(4-nitrophenyl)-2H-tetrazole, 2- -2H-tetrazole, 2-(4-Nitrophenyl)-2H-tetraazole, 4-(Tetrazol-2-yl)nitrobenzene
| Molecular Formula | C7H5N5O2 |
|---|---|
| Molecular Weight | 191.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 89.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.04433 |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 52708-38-0 |
|---|---|
| SMILES | C1=CC(=CC=C1N2N=CN=N2)[N+](=O)[O-] |
| InChIKey | NJLAQWFIXLFBKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Nitrophenyl)-2H-tetrazole (CAS 52708-38-0), with molecular formula C7H5N5O2 and molecular weight 191.04 g/mol. IUPAC: 2-(4-nitrophenyl)tetrazole.
Chemical Property Profile of 2-(4-Nitrophenyl)-2H-tetrazole
Property Insights of 2-(4-Nitrophenyl)-2H-tetrazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Nitrophenyl)-2H-tetrazole. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrophenyl)-2H-tetrazole. Following Lipinski's Rule of Five, 2-(4-Nitrophenyl)-2H-tetrazole has 0 hydrogen bond donor(s) and 5 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 2-(4-Nitrophenyl)-2H-tetrazole?
The CAS number of 2-(4-Nitrophenyl)-2H-tetrazole is 52708-38-0.
What is the molecular formula of 2-(4-Nitrophenyl)-2H-tetrazole?
The molecular formula of 2-(4-Nitrophenyl)-2H-tetrazole is C7H5N5O2.
What is the molecular weight of 2-(4-Nitrophenyl)-2H-tetrazole?
The molecular weight of 2-(4-Nitrophenyl)-2H-tetrazole is 191.04 g/mol.
Where can I buy 2-(4-Nitrophenyl)-2H-tetrazole?
You can request a quote for 2-(4-Nitrophenyl)-2H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitrophenyl)-2H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrophenyl)-2H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.