Tributyl borate
TL;DR: Tributyl borate (CAS 688-74-4) 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.
硼酸三丁酯
tributyl borate
Also Known As: TRIBUTYL BORATE, Tributoxyborane, Tri-n-butyl borate, Tributoxyboron, n-Butyl borate
Application Areas
Top 5 of 22 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 | 12 |
| Exact Mass | 230.20532 Da |
| Heavy Atoms | 16 |
| Complexity | 110.0 |
| Melting Point | less than -94 °F (NTP, 1992) |
| Boiling Point | 446 to 448 °F at 760 mmHg (NTP, 1992) |
| Density | 0.8567 at 68 °F (NTP, 1992) - Less dense than water; will float |
| Flash Point | 200 °F (open cup) |
| Vapor Pressure | 0.52 [mmHg] |
| Refractive Index | Index of refraction: 1.4106 at 18 °C/D |
| Solubility | Decomposes (NTP, 1992) |
| SMILES | B(OCCCC)(OCCCC)OCCCC |
| InChIKey | LGQXXHMEBUOXRP-UHFFFAOYSA-N |
Product Description
Applications: Tributyl borate is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Tributyl borate (CAS 688-74-4) is a polymer intermediate with the molecular formula C12H27BO3 and a molecular weight of 230.21 g/mol. Key physical properties include a density of 0.8567 at 68 °F (NTP, 1992) - Less dense than water; will float g/cm³, a solubility: Decomposes (NTP, 1992). Synonyms include TRIBUTYL BORATE and Tributoxyborane.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Tributyl borate
Property Insights of Tributyl borate
The XLogP value of 3.42 indicates that Tributyl 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, Tributyl borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tributyl 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 Tributyl borate?
The CAS number of Tributyl borate is 688-74-4.
What is the molecular formula of Tributyl borate?
The molecular formula of Tributyl borate is C12H27BO3.
What is the molecular weight of Tributyl borate?
The molecular weight of Tributyl borate is 230.20532 g/mol.
What are the applications of Tributyl borate?
Tributyl borate is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Tributyl borate?
You can request a quote for Tributyl borate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tributyl borate?
Yes, CoreyChem provides custom synthesis services for Tributyl borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.