1,2,3,4,5,6-Hexachlorohexane
TL;DR: 1,2,3,4,5,6-Hexachlorohexane (CAS 18585-38-1) is a chemical compound with molecular formula C6H8Cl6 and molecular weight 289.8757 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4,5,6-hexachlorohexane
Also Known As: 1,2,3,4,5,6-HEXACHLOROHEXANE, J1.557.295G
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H8Cl6 |
| Molecular Weight | 289.8757 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.87277 Da |
| Heavy Atoms | 12 |
| Complexity | 105.0 |
| SMILES | C(C(C(C(C(CCl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | YKDXWABQPBLJDI-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,3,4,5,6-Hexachlorohexane
Property Insights of 1,2,3,4,5,6-Hexachlorohexane
The XLogP value of 4.0 indicates that 1,2,3,4,5,6-Hexachlorohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3,4,5,6-Hexachlorohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,5,6-Hexachlorohexane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,3,4,5,6-Hexachlorohexane?
The CAS number of 1,2,3,4,5,6-Hexachlorohexane is 18585-38-1.
What is the molecular formula of 1,2,3,4,5,6-Hexachlorohexane?
The molecular formula of 1,2,3,4,5,6-Hexachlorohexane is C6H8Cl6.
What is the molecular weight of 1,2,3,4,5,6-Hexachlorohexane?
The molecular weight of 1,2,3,4,5,6-Hexachlorohexane is 289.8757 g/mol.
Where can I buy 1,2,3,4,5,6-Hexachlorohexane?
You can request a quote for 1,2,3,4,5,6-Hexachlorohexane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,3,4,5,6-Hexachlorohexane?
Yes, CoreyChem provides custom synthesis services for 1,2,3,4,5,6-Hexachlorohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.