Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-
TL;DR: Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- (CAS 68845-00-1) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxy-2,6,6-trimethyl-9-methylidenebicyclo[3.3.1]nonane
Also Known As: BOISIRIS, Physeol, woody nonane, Bis(2,2,2-trifluoroethyl)ether, 2-Ethoxy-2,6,6-trimethyl-9-methylenebicyclo[3.3.1]nonane
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 68845-00-1 |
|---|---|
| SMILES | CCOC1(CCC2C(=C)C1CCC2(C)C)C |
| InChIKey | LUNAXRIJWWBQTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- (CAS 68845-00-1), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 2-ethoxy-2,6,6-trimethyl-9-methylidenebicyclo[3.3.1]nonane.
Chemical Property Profile of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-
Property Insights of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-
The XLogP value of 3.6 indicates that Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- has 0 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 Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-?
The CAS number of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- is 68845-00-1.
What is the molecular formula of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-?
The molecular formula of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- is C15H26O.
What is the molecular weight of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-?
The molecular weight of Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- is 222.20 g/mol.
Where can I buy Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-?
You can request a quote for Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[3.3.1]nonane, 2-ethoxy-2,6,6-trimethyl-9-methylene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.