Tridecylboronic acid
TL;DR: Tridecylboronic acid (CAS 1449291-52-4) is a chemical compound with molecular formula C13H29BO2 and molecular weight 228.22606 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tridecylboronic acid
Also Known As: tridecylboronic acid, 1-tridecylboronic acid, 4m1j, N-TRIDECANEBORONIC ACID, NCI60_013059
Technical Specifications
| Molecular Formula | C13H29BO2 |
| Molecular Weight | 228.22606 g/mol |
| XLogP | 3.7702 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 228.22606 Da |
| Heavy Atoms | 16 |
| Complexity | 129.0 |
| SMILES | B(CCCCCCCCCCCCC)(O)O |
| InChIKey | IBKXABQGVIIFFS-UHFFFAOYSA-N |
Chemical Property Profile of Tridecylboronic acid
Property Insights of Tridecylboronic acid
The XLogP value of 3.7702 indicates that Tridecylboronic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Tridecylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tridecylboronic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tridecylboronic acid?
The CAS number of Tridecylboronic acid is 1449291-52-4.
What is the molecular formula of Tridecylboronic acid?
The molecular formula of Tridecylboronic acid is C13H29BO2.
What is the molecular weight of Tridecylboronic acid?
The molecular weight of Tridecylboronic acid is 228.22606 g/mol.
Where can I buy Tridecylboronic acid?
You can request a quote for Tridecylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tridecylboronic acid?
Yes, CoreyChem provides custom synthesis services for Tridecylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.