![2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile structure](/static/products/915/915872-31-0.png)
2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile
TL;DR: 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile (CAS 915872-31-0) is a chemical compound with molecular formula C9H6FN5 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(2-fluorophenyl)tetrazol-2-yl]acetonitrile
Also Known As: 2-[5-(2-fluorophenyl)tetrazol-2-yl]acetonitrile, [5-(2-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile, 2-[5-(2-fluorophenyl)-1,2,3,4-tetraazol-2-yl]ethanenitrile, 2H-1,2,3,4-Tetrazole-2-acetonitrile, 5-(2-fluorophenyl)-, [5-(2-FLUOROPHENYL)-2H-1,2,3,4-TETRAAZOL-2-YL]METHYL CYANIDE
| Molecular Formula | C9H6FN5 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 1.00278 |
| Topological Polar Surface Area | 67.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.06073 |
| Heavy Atoms | 15 |
| Complexity | 513.21643 |
Chemical Identifiers
| CAS Number | 915872-31-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NN(N=N2)CC#N)F |
Product Overview
2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile (CAS 915872-31-0), with molecular formula C9H6FN5 and molecular weight 203.06 g/mol. IUPAC: 2-[5-(2-fluorophenyl)tetrazol-2-yl]acetonitrile.
Chemical Property Profile of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile
Property Insights of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile
The XLogP value of 1.00278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile. Following Lipinski's Rule of Five, 2-[5-(2-Fluorophenyl)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-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile?
The CAS number of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile is 915872-31-0.
What is the molecular formula of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile?
The molecular formula of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile is C9H6FN5.
What is the molecular weight of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile?
The molecular weight of 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile is 203.06 g/mol.
Where can I buy 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile?
You can request a quote for 2-[5-(2-Fluorophenyl)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-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(2-Fluorophenyl)tetrazol-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.