![5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one structure](/static/products/8365/836-52-2.webp)
5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one
TL;DR: 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one (CAS 836-52-2) is a chemical compound with molecular formula C8H5N3O5 and molecular weight 223.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one
Also Known As: 5-[2- vinyl]-1,3,4-oxadiazol-2 -one
| Molecular Formula | C8H5N3O5 |
|---|---|
| Molecular Weight | 223.02 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.02292 |
| Heavy Atoms | 16 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 836-52-2 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=CC2=NNC(=O)O2 |
| InChIKey | YMBYAWBQUZCBQZ-UHFFFAOYSA-N |
Product Overview
5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one (CAS 836-52-2), with molecular formula C8H5N3O5 and molecular weight 223.02 g/mol. IUPAC: 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one
Property Insights of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one. Following Lipinski's Rule of Five, 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one has 1 hydrogen bond donor(s) and 6 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-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one?
The CAS number of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one is 836-52-2.
What is the molecular formula of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one?
The molecular formula of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one is C8H5N3O5.
What is the molecular weight of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one?
The molecular weight of 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one is 223.02 g/mol.
Where can I buy 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one?
You can request a quote for 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.