![3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione structure](/static/products/6022/60224-29-5.webp)
3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione
TL;DR: 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione (CAS 60224-29-5) is a chemical compound with molecular formula C12H8O3 and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,9b-dihydrobenzo[e][2]benzofuran-1,3-dione
Also Known As: 3a,9b-dihydrobenzo[e][2]benzofuran-1,3-dione, 3a,9b-Dihydronaphtho[1,2-c]furan-1,3-dione, 1,2-dihydro-naphthalene-1,2-dicarboxylic acid anhydride
| Molecular Formula | C12H8O3 |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.04735 |
| Heavy Atoms | 15 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 60224-29-5 |
|---|---|
| SMILES | C1=CC=C2C3C(C=CC2=C1)C(=O)OC3=O |
| InChIKey | AHRPFDNVTYPIDQ-UHFFFAOYSA-N |
Product Overview
3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione (CAS 60224-29-5), with molecular formula C12H8O3 and molecular weight 200.05 g/mol. IUPAC: 3a,9b-dihydrobenzo[e][2]benzofuran-1,3-dione.
Chemical Property Profile of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione
Property Insights of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,9b-Dihydrobenzo[e][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 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione?
The CAS number of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione is 60224-29-5.
What is the molecular formula of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione?
The molecular formula of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione is C12H8O3.
What is the molecular weight of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione?
The molecular weight of 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione is 200.05 g/mol.
Where can I buy 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione?
You can request a quote for 3a,9b-Dihydrobenzo[e][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 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 3a,9b-Dihydrobenzo[e][2]benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.