1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-
TL;DR: 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- (CAS 109282-29-3) is a chemical compound with molecular formula C9H8O4 and molecular weight 180.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,11-dioxatetracyclo[4.3.1.12,5.01,6]undecane-7,9-dione
Also Known As: 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-, Tetrahydro-1H,3H-4,7-epoxy-3a,7a-methano-2-benzofuran-1,3-dione, RefChem:1057686
| Molecular Formula | C9H8O4 |
|---|---|
| Molecular Weight | 180.04 g/mol |
| LogP | 0.0075 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.04225 |
| Heavy Atoms | 13 |
| Complexity | 330.6262 |
Chemical Identifiers
| CAS Number | 109282-29-3 |
|---|---|
| SMILES | C1CC2C34CC3(C1O2)C(=O)OC4=O |
Product Overview
1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- (CAS 109282-29-3), with molecular formula C9H8O4 and molecular weight 180.04 g/mol. IUPAC: 8,11-dioxatetracyclo[4.3.1.12,5.01,6]undecane-7,9-dione.
Chemical Property Profile of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-
Property Insights of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-
The XLogP value of 0.0075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-. With a topological polar surface area (TPSA) of 52.6 Ų, 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- 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 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-?
The CAS number of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- is 109282-29-3.
What is the molecular formula of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-?
The molecular formula of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- is C9H8O4.
What is the molecular weight of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-?
The molecular weight of 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- is 180.04 g/mol.
Where can I buy 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-?
You can request a quote for 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for 1H,3H-4,7-Epoxy-3a,7a-methanoisobenzofuran-1,3-dione, tetrahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.