![9-Isopropoxy-9-borabicyclo[3.3.1]nonane structure](/static/products/800/80095-74-5.png)
9-Isopropoxy-9-borabicyclo[3.3.1]nonane
TL;DR: 9-Isopropoxy-9-borabicyclo[3.3.1]nonane (CAS 80095-74-5) is a chemical compound with molecular formula C11H21BO and molecular weight 180.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-propan-2-yloxy-9-borabicyclo[3.3.1]nonane
Also Known As: 9-Isopropoxy-9-borabicyclo[3.3.1]nonane, 9-Isopropoxy-9-borabicyclo[3.3.1]nonane #, 9-propan-2-yloxy-9-borabicyclo[3.3.1]nonane, 9-Borabicyclo[3.3.1]nonane, 9-(1-methylethoxy)-
| Molecular Formula | C11H21BO |
|---|---|
| Molecular Weight | 180.17 g/mol |
| LogP | 3.5111 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.16855 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 80095-74-5 |
|---|---|
| SMILES | B1(C2CCCC1CCC2)OC(C)C |
| InChIKey | WWAQGQQCCPPDNR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Isopropoxy-9-borabicyclo[3.3.1]nonane (CAS 80095-74-5), with molecular formula C11H21BO and molecular weight 180.17 g/mol. IUPAC: 9-propan-2-yloxy-9-borabicyclo[3.3.1]nonane.
Chemical Property Profile of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane
Property Insights of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane
The XLogP value of 3.5111 indicates that 9-Isopropoxy-9-borabicyclo[3.3.1]nonane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 9-Isopropoxy-9-borabicyclo[3.3.1]nonane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Isopropoxy-9-borabicyclo[3.3.1]nonane 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 9-Isopropoxy-9-borabicyclo[3.3.1]nonane?
The CAS number of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane is 80095-74-5.
What is the molecular formula of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane?
The molecular formula of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane is C11H21BO.
What is the molecular weight of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane?
The molecular weight of 9-Isopropoxy-9-borabicyclo[3.3.1]nonane is 180.17 g/mol.
Where can I buy 9-Isopropoxy-9-borabicyclo[3.3.1]nonane?
You can request a quote for 9-Isopropoxy-9-borabicyclo[3.3.1]nonane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Isopropoxy-9-borabicyclo[3.3.1]nonane?
Yes, KEHONG BIO provides custom synthesis services for 9-Isopropoxy-9-borabicyclo[3.3.1]nonane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.