三(2-苯基环己基)硼酸酯
TL;DR: 三(2-苯基环己基)硼酸酯 (CAS 5434-83-3) is a chemical compound with molecular formula C36H45BO3 and molecular weight 536.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三(2-苯基环己基)硼酸酯
tris(2-phenylcyclohexyl) borate
Also Known As: Tri(2-phenylcyclohexyl) borate, tris(2-phenylcyclohexyl) borate, Cyclohexanol, 2-phenyl-, borate, TRI(2-PHENYLCYCLOHEXYL)BORATE, BORIC ACID, TRIS(2-PHENYLCYCLOHEXYL) ESTER
| Molecular Formula | C36H45BO3 |
|---|---|
| Molecular Weight | 536.35 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.3462 |
| Heavy Atoms | 40 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 5434-83-3 |
|---|---|
| SMILES | B(OC1CCCCC1C2=CC=CC=C2)(OC3CCCCC3C4=CC=CC=C4)OC5CCCCC5C6=CC=CC=C6 |
| InChIKey | GHMDTEDTNDZHTB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三(2-苯基环己基)硼酸酯 (CAS 5434-83-3), with molecular formula C36H45BO3 and molecular weight 536.35 g/mol. IUPAC: tris(2-phenylcyclohexyl) borate.
Chemical Property Profile of 三(2-苯基环己基)硼酸酯
Property Insights of 三(2-苯基环己基)硼酸酯
The XLogP value of 9.2 indicates that 三(2-苯基环己基)硼酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 三(2-苯基环己基)硼酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三(2-苯基环己基)硼酸酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 三(2-苯基环己基)硼酸酯?
The CAS number of 三(2-苯基环己基)硼酸酯 is 5434-83-3.
What is the molecular formula of 三(2-苯基环己基)硼酸酯?
The molecular formula of 三(2-苯基环己基)硼酸酯 is C36H45BO3.
What is the molecular weight of 三(2-苯基环己基)硼酸酯?
The molecular weight of 三(2-苯基环己基)硼酸酯 is 536.35 g/mol.
Where can I buy 三(2-苯基环己基)硼酸酯?
You can request a quote for 三(2-苯基环己基)硼酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三(2-苯基环己基)硼酸酯?
Yes, KEHONG BIO provides custom synthesis services for 三(2-苯基环己基)硼酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.