Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate
TL;DR: Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate (CAS 2929-85-3) is a chemical compound with molecular formula C23H41BO3 and molecular weight 376.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutyl (2,6-ditert-butyl-4-methylphenyl) borate
Also Known As: starbld0019199, Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate, dibutyl 2,6-di-tert-butyl-4-methylphenyl borate, Dibutyl (2,6-di-tert-butyl-4-methylphenyl) borate, 2,6-Di-tert-butyl-p-cresyl-dibutyl borate
| Molecular Formula | C23H41BO3 |
|---|---|
| Molecular Weight | 376.31 g/mol |
| LogP | 6.59 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 376.31488 |
| Heavy Atoms | 27 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 2929-85-3 |
|---|---|
| SMILES | B(OCCCC)(OCCCC)OC1=C(C=C(C=C1C(C)(C)C)C)C(C)(C)C |
| InChIKey | HVQKGGXARPLXIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate (CAS 2929-85-3), with molecular formula C23H41BO3 and molecular weight 376.31 g/mol. IUPAC: dibutyl (2,6-ditert-butyl-4-methylphenyl) borate.
Chemical Property Profile of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate
Property Insights of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate
The XLogP value of 6.59 indicates that Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate 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 Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate?
The CAS number of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate is 2929-85-3.
What is the molecular formula of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate?
The molecular formula of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate is C23H41BO3.
What is the molecular weight of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate?
The molecular weight of Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate is 376.31 g/mol.
Where can I buy Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate?
You can request a quote for Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate?
Yes, KEHONG BIO provides custom synthesis services for Dibutyl 2,6-di-tert-butyl-4-tolyl orthoborate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.