Hercules 426-A
TL;DR: Hercules 426-A (CAS 3513-93-7) is a chemical compound with molecular formula C8H4Cl8 and molecular weight 379.78 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,7,7-hexachloro-5-(dichloromethyl)bicyclo[2.2.1]hept-2-ene
Also Known As: Hercules 426-A, Hercules-426A, ENT 23,447, KST-1B3576, 1,2,3,4,7,7-hexachloro-5-(dichloromethyl)bicyclo[2.2.1]hept-2-ene
| Molecular Formula | C8H4Cl8 |
|---|---|
| Molecular Weight | 379.78 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 383.7762 |
| Heavy Atoms | 16 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 3513-93-7 |
|---|---|
| SMILES | C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(Cl)Cl |
| InChIKey | IFACMWNIOXNWER-UHFFFAOYSA-N |
Product Overview
Hercules 426-A (CAS 3513-93-7), with molecular formula C8H4Cl8 and molecular weight 379.78 g/mol. IUPAC: 1,2,3,4,7,7-hexachloro-5-(dichloromethyl)bicyclo[2.2.1]hept-2-ene.
Chemical Property Profile of Hercules 426-A
Property Insights of Hercules 426-A
The XLogP value of 4.9 indicates that Hercules 426-A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Hercules 426-A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hercules 426-A 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
Frequently Asked Questions
What is the CAS number of Hercules 426-A?
The CAS number of Hercules 426-A is 3513-93-7.
What is the molecular formula of Hercules 426-A?
The molecular formula of Hercules 426-A is C8H4Cl8.
What is the molecular weight of Hercules 426-A?
The molecular weight of Hercules 426-A is 379.78 g/mol.
Where can I buy Hercules 426-A?
You can request a quote for Hercules 426-A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hercules 426-A?
Yes, KEHONG BIO provides custom synthesis services for Hercules 426-A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.