5-Ethenyl-2-benzofuran-1,3-dione
TL;DR: 5-Ethenyl-2-benzofuran-1,3-dione (CAS 27022-00-0) is a chemical compound with molecular formula C10H6O3 and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethenyl-2-benzofuran-1,3-dione
Also Known As: 5-ethenyl-2-benzofuran-1,3-dione, 4-vinylphthalic anhydride, 5-vinylisobenzofuran-1,3-dione, imidazo[5,1-b]thiazole-2-carbaldehyde, RefChem:302817
| Molecular Formula | C10H6O3 |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0317 |
| Heavy Atoms | 13 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 27022-00-0 |
|---|---|
| SMILES | C=CC1=CC2=C(C=C1)C(=O)OC2=O |
| InChIKey | OHMDZMAJDUVGHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Ethenyl-2-benzofuran-1,3-dione (CAS 27022-00-0), with molecular formula C10H6O3 and molecular weight 174.03 g/mol. IUPAC: 5-ethenyl-2-benzofuran-1,3-dione.
Chemical Property Profile of 5-Ethenyl-2-benzofuran-1,3-dione
Property Insights of 5-Ethenyl-2-benzofuran-1,3-dione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethenyl-2-benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 5-Ethenyl-2-benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethenyl-2-benzofuran-1,3-dione has 0 hydrogen bond donor(s) and 3 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-Ethenyl-2-benzofuran-1,3-dione?
The CAS number of 5-Ethenyl-2-benzofuran-1,3-dione is 27022-00-0.
What is the molecular formula of 5-Ethenyl-2-benzofuran-1,3-dione?
The molecular formula of 5-Ethenyl-2-benzofuran-1,3-dione is C10H6O3.
What is the molecular weight of 5-Ethenyl-2-benzofuran-1,3-dione?
The molecular weight of 5-Ethenyl-2-benzofuran-1,3-dione is 174.03 g/mol.
Where can I buy 5-Ethenyl-2-benzofuran-1,3-dione?
You can request a quote for 5-Ethenyl-2-benzofuran-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethenyl-2-benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethenyl-2-benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.