![[5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile structure](/static/products/392/392725-40-5.png)
[5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile
TL;DR: [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile (CAS 392725-40-5) 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-(4-fluorophenyl)tetrazol-2-yl]acetonitrile
Also Known As: 2-(5-(4-fluorophenyl)-2H-tetrazol-2-yl)acetonitrile, 2-[5-(4-fluorophenyl)tetrazol-2-yl]acetonitrile, [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile, 2-[5-(4-fluorophenyl)-1,2,3,4-tetraazol-2-yl]ethanenitrile
| 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 | 495.9664 |
Chemical Identifiers
| CAS Number | 392725-40-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN(N=N2)CC#N)F |
Product Overview
[5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile (CAS 392725-40-5), with molecular formula C9H6FN5 and molecular weight 203.06 g/mol. IUPAC: 2-[5-(4-fluorophenyl)tetrazol-2-yl]acetonitrile.
Chemical Property Profile of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile
Property Insights of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile
The XLogP value of 1.00278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile. The TPSA of 67.39 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile. Following Lipinski's Rule of Five, [5-(4-fluorophenyl)-2H-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 [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile?
The CAS number of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile is 392725-40-5.
What is the molecular formula of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile?
The molecular formula of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile is C9H6FN5.
What is the molecular weight of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile?
The molecular weight of [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile is 203.06 g/mol.
Where can I buy [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile?
You can request a quote for [5-(4-fluorophenyl)-2H-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 [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [5-(4-fluorophenyl)-2H-tetrazol-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.