9-Bbn-nopol benzyl etheradduct
TL;DR: 9-Bbn-nopol benzyl etheradduct (CAS 81971-15-5) is a chemical compound with molecular formula C26H39BO and molecular weight 378.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[6,6-dimethyl-2-(2-phenylmethoxyethyl)-3-bicyclo[3.1.1]heptanyl]-9-borabicyclo[3.3.1]nonane
Also Known As: 9-Bbn-nopol benzyl ether adduct, 9-Bbn-nopol benzyl etheradduct, 9-[6,6-dimethyl-4-(2-phenylmethoxyethyl)-3-bicyclo[3.1.1]heptanyl]-9-borabicyclo[3.3.1]nonane, 9-[7,7-dimethyl-2-(2-phenylmethoxyethyl)-3-bicyclo[3.1.1]heptyl]-9-borabicyclo[3.3.1]nonane
| Molecular Formula | C26H39BO |
|---|---|
| Molecular Weight | 378.31 g/mol |
| LogP | 7.2487 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.3094 |
| Heavy Atoms | 28 |
| Complexity | 633.6565 |
Chemical Identifiers
| CAS Number | 81971-15-5 |
|---|---|
| SMILES | B1(C2CCCC1CCC2)C3CC4CC(C3CCOCC5=CC=CC=C5)C4(C)C |
Product Overview
9-Bbn-nopol benzyl etheradduct (CAS 81971-15-5), with molecular formula C26H39BO and molecular weight 378.31 g/mol. IUPAC: 9-[6,6-dimethyl-2-(2-phenylmethoxyethyl)-3-bicyclo[3.1.1]heptanyl]-9-borabicyclo[3.3.1]nonane.
Chemical Property Profile of 9-Bbn-nopol benzyl etheradduct
Property Insights of 9-Bbn-nopol benzyl etheradduct
The XLogP value of 7.2487 indicates that 9-Bbn-nopol benzyl etheradduct is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 9-Bbn-nopol benzyl etheradduct exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Bbn-nopol benzyl etheradduct 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 9-Bbn-nopol benzyl etheradduct?
The CAS number of 9-Bbn-nopol benzyl etheradduct is 81971-15-5.
What is the molecular formula of 9-Bbn-nopol benzyl etheradduct?
The molecular formula of 9-Bbn-nopol benzyl etheradduct is C26H39BO.
What is the molecular weight of 9-Bbn-nopol benzyl etheradduct?
The molecular weight of 9-Bbn-nopol benzyl etheradduct is 378.31 g/mol.
Where can I buy 9-Bbn-nopol benzyl etheradduct?
You can request a quote for 9-Bbn-nopol benzyl etheradduct directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Bbn-nopol benzyl etheradduct?
Yes, KEHONG BIO provides custom synthesis services for 9-Bbn-nopol benzyl etheradduct and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.