![4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene structure](/static/products/5431/5431-70-9.webp)
4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene
TL;DR: 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene (CAS 5431-70-9) is a chemical compound with molecular formula C11H8Cl6O and molecular weight 365.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,9,10,11,12,12-hexachloro-4-oxatetracyclo[7.2.1.02,8.03,5]dodec-2(8)-ene
Also Known As: 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene, 1,9,10,11,12,12-Hexachloro-4-oxatetracyclo[7.2.1.02,8.03,5]dodec-2(8)-ene, HCE, 1,2,3,4,9,9-Hexachloro-exo-5,6-epoxy-1,4,4a,5,6, 7,8,8a-octahydro-1,4-methanonaphthalene
| Molecular Formula | C11H8Cl6O |
|---|---|
| Molecular Weight | 365.87 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 365.87064 |
| Heavy Atoms | 18 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 5431-70-9 |
|---|---|
| SMILES | C1CC2=C(C3C1O3)C4(C(C(C2(C4(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | AIRVKKDUPRDQTC-UHFFFAOYSA-N |
Product Overview
4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene (CAS 5431-70-9), with molecular formula C11H8Cl6O and molecular weight 365.87 g/mol. IUPAC: 1,9,10,11,12,12-hexachloro-4-oxatetracyclo[7.2.1.02,8.03,5]dodec-2(8)-ene.
Chemical Property Profile of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene
Property Insights of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene. With a topological polar surface area (TPSA) of 12.5 Ų, 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene has 0 hydrogen bond donor(s) and 1 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 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene?
The CAS number of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene is 5431-70-9.
What is the molecular formula of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene?
The molecular formula of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene is C11H8Cl6O.
What is the molecular weight of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene?
The molecular weight of 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene is 365.87 g/mol.
Where can I buy 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene?
You can request a quote for 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene?
Yes, KEHONG BIO provides custom synthesis services for 4,5,6,7,8,8-hexachloro-1a,2,3,4,5,6,7,7b-octahydro-4,7-methanonaphtho[1,2-b]oxirene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.