Dihydroisodrin
TL;DR: Dihydroisodrin (CAS 2387-13-5) is a chemical compound with molecular formula C12H10Cl6 and molecular weight 363.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5,6,12,12-hexachlorotetracyclo[6.2.1.13,6.02,7]dodec-4-ene
Also Known As: Dihydroisodrin, 5,6,7,8,9,9-hexachloro-1,2,3,4,4a,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalene, 3,4,5,6,12,12-hexachlorotetracyclo[6.2.1.13,6.02,7]dodec-4-ene, 1,2,3,4,10,10-Hexachloro-1,4,4a,5,6,7,8,8a-octahydro-1,4-endo-endo-5,8-dimethanonaphthalene, 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,10,10-hexachloro-1,4,4a,5,6,7,8,8a,-octahydro-, (1alpha,4a,4abeta,5alpha,8alpha,8abeta)-
| Molecular Formula | C12H10Cl6 |
|---|---|
| Molecular Weight | 363.89 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 365.88843 |
| Heavy Atoms | 18 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 2387-13-5 |
|---|---|
| SMILES | C1CC2CC1C3C2C4(C(=C(C3(C4(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | HNSZJJAOLVQMQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihydroisodrin (CAS 2387-13-5), with molecular formula C12H10Cl6 and molecular weight 363.89 g/mol. IUPAC: 3,4,5,6,12,12-hexachlorotetracyclo[6.2.1.13,6.02,7]dodec-4-ene.
Chemical Property Profile of Dihydroisodrin
Property Insights of Dihydroisodrin
The XLogP value of 5.2 indicates that Dihydroisodrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Dihydroisodrin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroisodrin has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydroisodrin?
The CAS number of Dihydroisodrin is 2387-13-5.
What is the molecular formula of Dihydroisodrin?
The molecular formula of Dihydroisodrin is C12H10Cl6.
What is the molecular weight of Dihydroisodrin?
The molecular weight of Dihydroisodrin is 363.89 g/mol.
Where can I buy Dihydroisodrin?
You can request a quote for Dihydroisodrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroisodrin?
Yes, KEHONG BIO provides custom synthesis services for Dihydroisodrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.