![(3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione structure](/static/products/1459/1459-16-1.webp)
(3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione
TL;DR: (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione (CAS 1459-16-1) is a chemical compound with molecular formula C12H10O3 and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione
Also Known As: J1.424.429H, 3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione, (3aR)-3abeta,4,9,9abeta-Tetrahydronaphtho[2,3-c]furan-1,3-dione, (3aR,9aS)-1H,3H,3aH,4H,9H,9aH-naphtho[2,3-c]furan-1,3-dione, (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione
| Molecular Formula | C12H10O3 |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 1.101 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.06299 |
| Heavy Atoms | 15 |
| Complexity | 408.9354 |
Chemical Identifiers
| CAS Number | 1459-16-1 |
|---|---|
| SMILES | C1[C@@H]2[C@H](CC3=CC=CC=C31)C(=O)OC2=O |
Product Overview
(3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione (CAS 1459-16-1), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione.
Chemical Property Profile of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione
Property Insights of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione
The XLogP value of 1.101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 43.37 Ų, (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][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 (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione?
The CAS number of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione is 1459-16-1.
What is the molecular formula of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione?
The molecular formula of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione is C12H10O3.
What is the molecular weight of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione?
The molecular weight of (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione is 202.06 g/mol.
Where can I buy (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione?
You can request a quote for (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][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 (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (3aS,9aR)-3a,4,9,9a-tetrahydrobenzo[f][2]benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.