Trihexadecyl Borate
TL;DR: Trihexadecyl Borate (CAS 2668-07-7) is a chemical compound with molecular formula C48H99BO3 and molecular weight 734.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trihexadecyl borate
Also Known As: Trihexadecyl borate, Boric Acid Tricetyl Ester, Boric Acid Trihexadecyl Ester, Boric acid Tri-n-hexadecyl Ester, BORICACIDTRI-N-HEXADECYLESTER
| Molecular Formula | C48H99BO3 |
|---|---|
| Molecular Weight | 734.77 g/mol |
| LogP | 17.465 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 48 |
| Exact Mass | 734.76874 |
| Heavy Atoms | 52 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 2668-07-7 |
|---|---|
| SMILES | B(OCCCCCCCCCCCCCCCC)(OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC |
| InChIKey | WZGVRXXJKGXOBR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trihexadecyl Borate (CAS 2668-07-7), with molecular formula C48H99BO3 and molecular weight 734.77 g/mol. IUPAC: trihexadecyl borate.
Chemical Property Profile of Trihexadecyl Borate
Property Insights of Trihexadecyl Borate
The XLogP value of 17.465 indicates that Trihexadecyl 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, Trihexadecyl Borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trihexadecyl 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 Trihexadecyl Borate?
The CAS number of Trihexadecyl Borate is 2668-07-7.
What is the molecular formula of Trihexadecyl Borate?
The molecular formula of Trihexadecyl Borate is C48H99BO3.
What is the molecular weight of Trihexadecyl Borate?
The molecular weight of Trihexadecyl Borate is 734.77 g/mol.
Where can I buy Trihexadecyl Borate?
You can request a quote for Trihexadecyl Borate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trihexadecyl Borate?
Yes, KEHONG BIO provides custom synthesis services for Trihexadecyl Borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.