Triisopropyl borate
TL;DR: Triisopropyl borate (CAS 5419-55-6) is a chemical compound with molecular formula C9H21BO3 and molecular weight 188.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tripropan-2-yl borate
Also Known As: TRIISOPROPYL BORATE, Isopropyl borate, Triisopropoxyborane, Triisopropoxyboron, Boron isopropoxide
| Molecular Formula | C9H21BO3 |
|---|---|
| Molecular Weight | 188.16 g/mol |
| LogP | 2.25 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 188.15837 |
| Heavy Atoms | 13 |
| Complexity | 102.0 |
| Flash Point | 27.8 °C (NFPA, 2010) |
| Vapor Pressure | 8.6 [mmHg] |
Chemical Identifiers
| CAS Number | 5419-55-6 |
|---|---|
| SMILES | B(OC(C)C)(OC(C)C)OC(C)C |
| InChIKey | NHDIQVFFNDKAQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triisopropyl borate (CAS 5419-55-6), with molecular formula C9H21BO3 and molecular weight 188.16 g/mol. IUPAC: tripropan-2-yl borate.
Chemical Property Profile of Triisopropyl borate
Property Insights of Triisopropyl borate
The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triisopropyl borate. With a topological polar surface area (TPSA) of 27.7 Ų, Triisopropyl borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triisopropyl 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
Frequently Asked Questions
What is the CAS number of Triisopropyl borate?
The CAS number of Triisopropyl borate is 5419-55-6.
What is the molecular formula of Triisopropyl borate?
The molecular formula of Triisopropyl borate is C9H21BO3.
What is the molecular weight of Triisopropyl borate?
The molecular weight of Triisopropyl borate is 188.16 g/mol.
Where can I buy Triisopropyl borate?
You can request a quote for Triisopropyl borate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triisopropyl borate?
Yes, KEHONG BIO provides custom synthesis services for Triisopropyl borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.