4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione
TL;DR: 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione (CAS 7319-41-7) is a chemical compound with molecular formula C8H2Cl4O3 and molecular weight 285.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5,6,7-tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione
Also Known As: 4,5,6,7-tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione, 1,3-Isobenzofurandione,4,5,6,7-tetrachloro-3a,7a-dihydro-
| Molecular Formula | C8H2Cl4O3 |
|---|---|
| Molecular Weight | 285.88 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.8758 |
| Heavy Atoms | 15 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 7319-41-7 |
|---|---|
| SMILES | C12C(C(=C(C(=C1Cl)Cl)Cl)Cl)C(=O)OC2=O |
| InChIKey | HFUBWSYLMUCDLL-UHFFFAOYSA-N |
Product Overview
4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione (CAS 7319-41-7), with molecular formula C8H2Cl4O3 and molecular weight 285.88 g/mol. IUPAC: 4,5,6,7-tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione.
Chemical Property Profile of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione
Property Insights of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrachloro-3a,7a-dihydro-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 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione?
The CAS number of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione is 7319-41-7.
What is the molecular formula of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione?
The molecular formula of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione is C8H2Cl4O3.
What is the molecular weight of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione?
The molecular weight of 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione is 285.88 g/mol.
Where can I buy 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione?
You can request a quote for 4,5,6,7-Tetrachloro-3a,7a-dihydro-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 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7-Tetrachloro-3a,7a-dihydro-2-benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.