7,12-Dioxaspiro(5,6)dodec-9-ene
TL;DR: 7,12-Dioxaspiro(5,6)dodec-9-ene (CAS 4771-07-7) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,12-dioxaspiro[5.6]dodec-9-ene
Also Known As: 7,12-dioxaspiro[5.6]dodec-9-ene, 7,12-Dioxa-spiro[5.6]dodec-9-ene, starbld0044599, 1,6-Dioxaspiro[6.5]dodeca-3-ene, 7,12-dioxaspiro[5,6]dodec-9-ene
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 4771-07-7 |
|---|---|
| SMILES | C1CCC2(CC1)OCC=CCO2 |
| InChIKey | CTCFVVBASGCJPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7,12-Dioxaspiro(5,6)dodec-9-ene (CAS 4771-07-7), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 7,12-dioxaspiro[5.6]dodec-9-ene.
Chemical Property Profile of 7,12-Dioxaspiro(5,6)dodec-9-ene
Property Insights of 7,12-Dioxaspiro(5,6)dodec-9-ene
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,12-Dioxaspiro(5,6)dodec-9-ene. With a topological polar surface area (TPSA) of 18.5 Ų, 7,12-Dioxaspiro(5,6)dodec-9-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,12-Dioxaspiro(5,6)dodec-9-ene has 0 hydrogen bond donor(s) and 2 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 7,12-Dioxaspiro(5,6)dodec-9-ene?
The CAS number of 7,12-Dioxaspiro(5,6)dodec-9-ene is 4771-07-7.
What is the molecular formula of 7,12-Dioxaspiro(5,6)dodec-9-ene?
The molecular formula of 7,12-Dioxaspiro(5,6)dodec-9-ene is C10H16O2.
What is the molecular weight of 7,12-Dioxaspiro(5,6)dodec-9-ene?
The molecular weight of 7,12-Dioxaspiro(5,6)dodec-9-ene is 168.12 g/mol.
Where can I buy 7,12-Dioxaspiro(5,6)dodec-9-ene?
You can request a quote for 7,12-Dioxaspiro(5,6)dodec-9-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,12-Dioxaspiro(5,6)dodec-9-ene?
Yes, KEHONG BIO provides custom synthesis services for 7,12-Dioxaspiro(5,6)dodec-9-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.