![Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate structure](/static/products/841/84113-76-8.png)
Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate
TL;DR: Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate (CAS 84113-76-8) is a chemical compound with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate
Also Known As: BAS 03207256, ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate, ethyl 2-(5-(p-tolyl)-2H-tetrazol-2-yl)acetate, (5-p-Tolyl-tetrazol-2-yl)-acetic acid ethyl ester, Ethyl 2-(5-(4-methylphenyl)-2H-1,2,3,4-tetraazol-2-yl)acetate
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 84113-76-8 |
|---|---|
| SMILES | CCOC(=O)CN1N=C(N=N1)C2=CC=C(C=C2)C |
| InChIKey | CNVZSGWRYPAORK-UHFFFAOYSA-N |
Product Overview
Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate (CAS 84113-76-8), with molecular formula C12H14N4O2 and molecular weight 246.11 g/mol. IUPAC: ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate.
Chemical Property Profile of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate
Property Insights of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate 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 Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate?
The CAS number of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate is 84113-76-8.
What is the molecular formula of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate?
The molecular formula of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate is C12H14N4O2.
What is the molecular weight of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate?
The molecular weight of Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate is 246.11 g/mol.
Where can I buy Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate?
You can request a quote for Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.