Chlorendic Anhydride
TL;DR: Chlorendic Anhydride (CAS 115-27-5) is a chemical compound with molecular formula C9H2Cl6O3 and molecular weight 367.8135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,7,8,9,10,10-hexachloro-4-oxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: CHLORENDIC ANHYDRIDE, HET anhydride, Chloran 542, Chlorendic anhydride (VAN), Chlorendic acid anhydride
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H2Cl6O3 |
| Molecular Weight | 367.8135 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 369.81055 Da |
| Heavy Atoms | 18 |
| Complexity | 498.0 |
| Melting Point | 239 °C |
| Density | 1.73 kg/L |
| Vapor Pressure | 5.5X10-7 mm Hg @ 25 °C /Estimated/ |
| Solubility | Readily sol in acetone, benzene, toluene; slightly sol in water, n-hexane, carbon tetrachloride |
| SMILES | C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | FLBJFXNAEMSXGL-UHFFFAOYSA-N |
Chemical Property Profile of Chlorendic Anhydride
Property Insights of Chlorendic Anhydride
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chlorendic Anhydride. With a topological polar surface area (TPSA) of 43.4 Ų, Chlorendic Anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorendic 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
What is the CAS number of Chlorendic Anhydride?
The CAS number of Chlorendic Anhydride is 115-27-5.
What is the molecular formula of Chlorendic Anhydride?
The molecular formula of Chlorendic Anhydride is C9H2Cl6O3.
What is the molecular weight of Chlorendic Anhydride?
The molecular weight of Chlorendic Anhydride is 367.8135 g/mol.
Where can I buy Chlorendic Anhydride?
You can request a quote for Chlorendic Anhydride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorendic Anhydride?
Yes, CoreyChem provides custom synthesis services for Chlorendic Anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.