![2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile structure](/static/products/460/460363-90-0.png)
2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile
TL;DR: 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile (CAS 460363-90-0) is a chemical compound with molecular formula C11H11N5 and molecular weight 213.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-ethylphenyl)tetrazol-2-yl]acetonitrile
Also Known As: ASN 04935556, 2-[5-(4-ethylphenyl)tetrazol-2-yl]acetonitrile, [5-(4-Ethyl-phenyl)-tetrazol-2-yl]-acetonitrile, 2H-Tetrazole-2-acetonitrile, 5-(4-ethylphenyl)- (9CI)
| Molecular Formula | C11H11N5 |
|---|---|
| Molecular Weight | 213.10 g/mol |
| LogP | 1.42608 |
| Topological Polar Surface Area | 67.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.10144 |
| Heavy Atoms | 16 |
| Complexity | 505.91635 |
Chemical Identifiers
| CAS Number | 460363-90-0 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2=NN(N=N2)CC#N |
Product Overview
2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile (CAS 460363-90-0), with molecular formula C11H11N5 and molecular weight 213.10 g/mol. IUPAC: 2-[5-(4-ethylphenyl)tetrazol-2-yl]acetonitrile.
Chemical Property Profile of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile
Property Insights of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile
The XLogP value of 1.42608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile. Following Lipinski's Rule of Five, 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile has 0 hydrogen bond donor(s) and 4 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-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile?
The CAS number of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile is 460363-90-0.
What is the molecular formula of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile?
The molecular formula of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile is C11H11N5.
What is the molecular weight of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile?
The molecular weight of 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile is 213.10 g/mol.
Where can I buy 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile?
You can request a quote for 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(4-Ethylphenyl)tetrazol-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.