Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-
TL;DR: Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- (CAS 67989-98-4) is a chemical compound with molecular formula C17H28O and molecular weight 248.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2,8-trimethyl-5-tricyclo[6.2.2.01,6]dodecanyl)ethanone
Also Known As: Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-, 1-(2,2,8-trimethyltricyclo[6.2.2.01,6]dodec-5-yl)ethanone, 1-ethoxy-3-(2-nitro-1h-imidazol-1-yl)propan-2-ol, 1-{2,2,8-trimethyltricyclo[6.2.2.01,6]dodecan-5-yl}ethan-1-one, 1-(2,5,5-Trimethyloctahydro-2H-2,4a-ethanonaphthalen-8-yl)ethan-1-one
| Molecular Formula | C17H28O |
|---|---|
| Molecular Weight | 248.21 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.21402 |
| Heavy Atoms | 18 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 67989-98-4 |
|---|---|
| SMILES | CC(=O)C1CCC(C23C1CC(CC2)(CC3)C)(C)C |
| InChIKey | RVDZMZCRDXUENU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- (CAS 67989-98-4), with molecular formula C17H28O and molecular weight 248.21 g/mol. IUPAC: 1-(2,2,8-trimethyl-5-tricyclo[6.2.2.01,6]dodecanyl)ethanone.
Chemical Property Profile of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-
Property Insights of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-
The XLogP value of 5.1 indicates that Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-?
The CAS number of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- is 67989-98-4.
What is the molecular formula of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-?
The molecular formula of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- is C17H28O.
What is the molecular weight of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-?
The molecular weight of Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- is 248.21 g/mol.
Where can I buy Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-?
You can request a quote for Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(octahydro-2,5,5-trimethyl-2H-2,4a-ethanonaphthalen-8-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.