![2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile structure](/static/products/7902/790263-25-1.webp)
2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
TL;DR: 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile (CAS 790263-25-1) is a chemical compound with molecular formula C10H6ClN3O and molecular weight 219.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
Also Known As: 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile, [3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
| Molecular Formula | C10H6ClN3O |
|---|---|
| Molecular Weight | 219.02 g/mol |
| LogP | 2.45608 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.01994 |
| Heavy Atoms | 15 |
| Complexity | 515.3812 |
Chemical Identifiers
| CAS Number | 790263-25-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NOC(=N2)CC#N)Cl |
Product Overview
2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile (CAS 790263-25-1), with molecular formula C10H6ClN3O and molecular weight 219.02 g/mol. IUPAC: 2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile.
Chemical Property Profile of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
Property Insights of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile
The XLogP value of 2.45608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile. The TPSA of 62.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile. Following Lipinski's Rule of Five, 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-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-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile?
The CAS number of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile is 790263-25-1.
What is the molecular formula of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile?
The molecular formula of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile is C10H6ClN3O.
What is the molecular weight of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile?
The molecular weight of 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile is 219.02 g/mol.
Where can I buy 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile?
You can request a quote for 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-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-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(2-Chlorophenyl)-1,2,4-oxadiazol-5-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.