Borester 7
TL;DR: Borester 7 (CAS 100-89-0) is a chemical compound with molecular formula C18H36B2O6 and molecular weight 370.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,6-trimethyl-2-[2-methyl-4-[(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)oxy]pentan-2-yl]oxy-1,3,2-dioxaborinane
Also Known As: Borester 7, Trihexylene glycol biborate, USAF BO-1, Trihexylene glycol diborate, trihexyleneglycol biborate
| Molecular Formula | C18H36B2O6 |
|---|---|
| Molecular Weight | 370.27 g/mol |
| LogP | 3.75 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.2698 |
| Heavy Atoms | 26 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 100-89-0 |
|---|---|
| SMILES | B1(OC(CC(O1)(C)C)C)OC(C)CC(C)(C)OB2OC(CC(O2)(C)C)C |
| InChIKey | QXMQBCRKITYLGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Borester 7 (CAS 100-89-0), with molecular formula C18H36B2O6 and molecular weight 370.27 g/mol. IUPAC: 4,4,6-trimethyl-2-[2-methyl-4-[(4,4,6-trimethyl-1,3,2-dioxaborinan-2-yl)oxy]pentan-2-yl]oxy-1,3,2-dioxaborinane.
Chemical Property Profile of Borester 7
Property Insights of Borester 7
The XLogP value of 3.75 indicates that Borester 7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Borester 7 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Borester 7 has 0 hydrogen bond donor(s) and 6 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 Borester 7?
The CAS number of Borester 7 is 100-89-0.
What is the molecular formula of Borester 7?
The molecular formula of Borester 7 is C18H36B2O6.
What is the molecular weight of Borester 7?
The molecular weight of Borester 7 is 370.27 g/mol.
Where can I buy Borester 7?
You can request a quote for Borester 7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Borester 7?
Yes, KEHONG BIO provides custom synthesis services for Borester 7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.