Tris(1-methylpropyl) borate
TL;DR: Tris(1-methylpropyl) borate (CAS 22238-17-1) is a chemical compound with molecular formula C12H27BO3 and molecular weight 230.20532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tributan-2-yl borate
Also Known As: Tri-sec-butyl borate, tributan-2-yl borate, Tri-sec-butoxyborane, sec-butyl borate, tri(s-butyl)borate
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H27BO3 |
| Molecular Weight | 230.20532 g/mol |
| XLogP | 3.42 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 230.20532 Da |
| Heavy Atoms | 16 |
| Complexity | 138.0 |
| SMILES | B(OC(C)CC)(OC(C)CC)OC(C)CC |
| InChIKey | MOFPNEADTSBYFQ-UHFFFAOYSA-N |
Chemical Property Profile of Tris(1-methylpropyl) borate
Property Insights of Tris(1-methylpropyl) borate
The XLogP value of 3.42 indicates that Tris(1-methylpropyl) borate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Tris(1-methylpropyl) borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(1-methylpropyl) borate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tris(1-methylpropyl) borate?
The CAS number of Tris(1-methylpropyl) borate is 22238-17-1.
What is the molecular formula of Tris(1-methylpropyl) borate?
The molecular formula of Tris(1-methylpropyl) borate is C12H27BO3.
What is the molecular weight of Tris(1-methylpropyl) borate?
The molecular weight of Tris(1-methylpropyl) borate is 230.20532 g/mol.
Where can I buy Tris(1-methylpropyl) borate?
You can request a quote for Tris(1-methylpropyl) borate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tris(1-methylpropyl) borate?
Yes, CoreyChem provides custom synthesis services for Tris(1-methylpropyl) borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.