Tris(2-cyclohexylcyclohexyl) borate
TL;DR: Tris(2-cyclohexylcyclohexyl) borate (CAS 5440-19-7) is a chemical compound with molecular formula C36H63BO3 and molecular weight 554.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(2-cyclohexylcyclohexyl) borate
Also Known As: Boricacidtris ester, Tri(2-cyclohexylcyclohexyl)borate, tris(2-cyclohexylcyclohexyl) borate, BORIC ACID, TRIS(2-CYCLOHEXYLCYCLOHEXYL) ESTER, [1, triester with boric acid (H3BO3)
| Molecular Formula | C36H63BO3 |
|---|---|
| Molecular Weight | 554.49 g/mol |
| LogP | 10.44 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 554.487 |
| Heavy Atoms | 40 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 5440-19-7 |
|---|---|
| SMILES | B(OC1CCCCC1C2CCCCC2)(OC3CCCCC3C4CCCCC4)OC5CCCCC5C6CCCCC6 |
| InChIKey | SFCBPVBDIBWEJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tris(2-cyclohexylcyclohexyl) borate (CAS 5440-19-7), with molecular formula C36H63BO3 and molecular weight 554.49 g/mol. IUPAC: tris(2-cyclohexylcyclohexyl) borate.
Chemical Property Profile of Tris(2-cyclohexylcyclohexyl) borate
Property Insights of Tris(2-cyclohexylcyclohexyl) borate
The XLogP value of 10.44 indicates that Tris(2-cyclohexylcyclohexyl) 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, Tris(2-cyclohexylcyclohexyl) borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tris(2-cyclohexylcyclohexyl) borate 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 Tris(2-cyclohexylcyclohexyl) borate?
The CAS number of Tris(2-cyclohexylcyclohexyl) borate is 5440-19-7.
What is the molecular formula of Tris(2-cyclohexylcyclohexyl) borate?
The molecular formula of Tris(2-cyclohexylcyclohexyl) borate is C36H63BO3.
What is the molecular weight of Tris(2-cyclohexylcyclohexyl) borate?
The molecular weight of Tris(2-cyclohexylcyclohexyl) borate is 554.49 g/mol.
Where can I buy Tris(2-cyclohexylcyclohexyl) borate?
You can request a quote for Tris(2-cyclohexylcyclohexyl) borate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(2-cyclohexylcyclohexyl) borate?
Yes, KEHONG BIO provides custom synthesis services for Tris(2-cyclohexylcyclohexyl) borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.