![9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- structure](/static/products/429/42928-43-8.png)
9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-
TL;DR: 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- (CAS 42928-43-8) is a chemical compound with molecular formula C12H23B and molecular weight 178.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-tert-butyl-9-borabicyclo[3.3.1]nonane
Also Known As: 9-tert-Butyl-9-borabicyclo[3.3.1]nonane, 9-tert-Butyl-9-borabicyclo[3.3.1]nonane #, J1.149.844B, 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-, InChI=1/C12H23B/c1-12(2,3)13-10-6-4-7-11(13)9-5-8-10/h10-11H,4-9H2,1-3H
| Molecular Formula | C12H23B |
|---|---|
| Molecular Weight | 178.19 g/mol |
| LogP | 4.3895 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.18929 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 42928-43-8 |
|---|---|
| SMILES | B1(C2CCCC1CCC2)C(C)(C)C |
| InChIKey | BGJOORDFIDKBML-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- (CAS 42928-43-8), with molecular formula C12H23B and molecular weight 178.19 g/mol. IUPAC: 9-tert-butyl-9-borabicyclo[3.3.1]nonane.
Chemical Property Profile of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-
Property Insights of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-
The XLogP value of 4.3895 indicates that 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- has 0 hydrogen bond donor(s) and 0 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-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-?
The CAS number of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- is 42928-43-8.
What is the molecular formula of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-?
The molecular formula of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- is C12H23B.
What is the molecular weight of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-?
The molecular weight of 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- is 178.19 g/mol.
Where can I buy 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-?
You can request a quote for 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9-Borabicyclo[3.3.1]nonane, 9-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.