1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL
TL;DR: 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL (CAS 7388-87-6) is a chemical compound with molecular formula C12H16O and molecular weight 176.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetracyclo[6.2.1.13,6.02,7]dodec-9-en-4-ol
Also Known As: 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL, 8-hydroxytetracyclo [4.4.0.12,5.17,10]dodec-3-ene, tetracyclo[6.2.1.1^{3,6}.0^{2,7}]dodec-9-en-4-ol, 1,2,3,4,4A,5,8,8a-octahydro-1,4:5,8-dimethanonaphthalen-2-ol, 1,8-Dimethanonaphthalen-2-ol, 1,2,3,4,4a,5,8,8a-octahydro-
| Molecular Formula | C12H16O |
|---|---|
| Molecular Weight | 176.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.12012 |
| Heavy Atoms | 13 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 7388-87-6 |
|---|---|
| SMILES | C1C2CC(C1C3C2C4CC3C=C4)O |
| InChIKey | MFZJGMQSIBNILS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL (CAS 7388-87-6), with molecular formula C12H16O and molecular weight 176.12 g/mol. IUPAC: tetracyclo[6.2.1.13,6.02,7]dodec-9-en-4-ol.
Chemical Property Profile of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL
Property Insights of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL. With a topological polar surface area (TPSA) of 20.2 Ų, 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL has 1 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 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL?
The CAS number of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL is 7388-87-6.
What is the molecular formula of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL?
The molecular formula of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL is C12H16O.
What is the molecular weight of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL?
The molecular weight of 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL is 176.12 g/mol.
Where can I buy 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL?
You can request a quote for 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,4A,5,8,8A-OCTAHYDRO-1,4:5,8-DIMETHANO-2-NAPHTHOL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.