Chlorendic Anhydride
TL;DR: Chlorendic Anhydride (CAS 115-27-5) is a chemical compound with molecular formula C9H2Cl6O3 and molecular weight 367.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C9H2Cl6O3 |
|---|---|
| Molecular Weight | 367.81 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 369.81055 |
| Heavy Atoms | 18 |
| Complexity | 498.0 |
| Melting Point | 239 °C |
| Density | 1.73 kg/L |
| Solubility | Readily sol in acetone, benzene, toluene; slightly sol in water, n-hexane, carbon tetrachloride |
| Vapor Pressure | 5.5X10-7 mm Hg @ 25 °C /Estimated/ |
Chemical Identifiers
| CAS Number | 115-27-5 |
|---|---|
| SMILES | C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | FLBJFXNAEMSXGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chlorendic Anhydride (CAS 115-27-5), with molecular formula C9H2Cl6O3 and molecular weight 367.81 g/mol. IUPAC: 1,7,8,9,10,10-hexachloro-4-oxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
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
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 367.81 g/mol.
Where can I buy Chlorendic Anhydride?
You can request a quote for Chlorendic Anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorendic Anhydride?
Yes, KEHONG BIO provides custom synthesis services for Chlorendic Anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.