Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride
TL;DR: Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride (CAS 7780-34-9) is a chemical compound with molecular formula C10H10O3 and molecular weight 178.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione
Also Known As: Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic anhydride, 3a,4,7,7a-Tetrahydro-4,7-ethanoisobenzofuran-1,3-dione, YIHKILSPWGDWPR-UHFFFAOYSA-, bicyclooctenedicarboxylic anhydride, 4-Oxatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione
| Molecular Formula | C10H10O3 |
|---|---|
| Molecular Weight | 178.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.06299 |
| Heavy Atoms | 13 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 7780-34-9 |
|---|---|
| SMILES | C1CC2C=CC1C3C2C(=O)OC3=O |
| InChIKey | YIHKILSPWGDWPR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride (CAS 7780-34-9), with molecular formula C10H10O3 and molecular weight 178.06 g/mol. IUPAC: 4-oxatricyclo[5.2.2.02,6]undec-8-ene-3,5-dione.
Chemical Property Profile of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride
Property Insights of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride. With a topological polar surface area (TPSA) of 43.4 Ų, Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride 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 Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride?
The CAS number of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride is 7780-34-9.
What is the molecular formula of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride?
The molecular formula of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride is C10H10O3.
What is the molecular weight of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride?
The molecular weight of Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride is 178.06 g/mol.
Where can I buy Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride?
You can request a quote for Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(2.2.2)oct-5-ene-2,3-dicarboxylic Anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.