![bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate structure](/static/products/6792/67921-33-9.webp)
bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate
TL;DR: bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate (CAS 67921-33-9) is a chemical compound with molecular formula C15H14Cl6N2O5 and molecular weight 511.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate
Also Known As: bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate, Bis(2,2,2-trichloroethyl) (3aS,4R,7R)-2,3,4,7-tetrahydro-1H-4,7-diazano-3a,7a-epoxyindene-9,10-dicarboxylate
| Molecular Formula | C15H14Cl6N2O5 |
|---|---|
| Molecular Weight | 511.90 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 511.90338 |
| Heavy Atoms | 28 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 67921-33-9 |
|---|---|
| SMILES | C1C[C@]23[C@H]4C=C[C@H](C2(C1)O3)N(N4C(=O)OCC(Cl)(Cl)Cl)C(=O)OCC(Cl)(Cl)Cl |
| InChIKey | OTNXCEZAJIBNHE-MUWIMTQBSA-N |
Product Overview
bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate (CAS 67921-33-9), with molecular formula C15H14Cl6N2O5 and molecular weight 511.90 g/mol. IUPAC: bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate.
Chemical Property Profile of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate
Property Insights of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate
The XLogP value of 4.2 indicates that bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate. Following Lipinski's Rule of Five, bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate?
The CAS number of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate is 67921-33-9.
What is the molecular formula of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate?
The molecular formula of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate is C15H14Cl6N2O5.
What is the molecular weight of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate?
The molecular weight of bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate is 511.90 g/mol.
Where can I buy bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate?
You can request a quote for bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for bis(2,2,2-trichloroethyl) (1R,2S,7R)-12-oxa-8,9-diazatetracyclo[5.2.2.12,6.02,6]dodec-10-ene-8,9-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.