2-(Dicyclohexylamino)-ethanol borate
TL;DR: 2-(Dicyclohexylamino)-ethanol borate (CAS 7539-58-4) is a chemical compound with molecular formula C42H78BN3O3 and molecular weight 683.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris[2-(dicyclohexylamino)ethyl] borate
Also Known As: tris[2- ethyl]borate, tris[2-(dicyclohexylamino)ethyl] borate, 2-(Dicyclohexylamino)-ethanol borate, Tris(N,N-dicyclohexylaminoethyl)borate, Tris(2-(dicyclohexylamino)ethyl) borate
| Molecular Formula | C42H78BN3O3 |
|---|---|
| Molecular Weight | 683.61 g/mol |
| LogP | 9.92 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 683.61365 |
| Heavy Atoms | 49 |
| Complexity | 683.0 |
Chemical Identifiers
| CAS Number | 7539-58-4 |
|---|---|
| SMILES | B(OCCN(C1CCCCC1)C2CCCCC2)(OCCN(C3CCCCC3)C4CCCCC4)OCCN(C5CCCCC5)C6CCCCC6 |
| InChIKey | CLLRNFFLFVAFFV-UHFFFAOYSA-N |
Product Overview
2-(Dicyclohexylamino)-ethanol borate (CAS 7539-58-4), with molecular formula C42H78BN3O3 and molecular weight 683.61 g/mol. IUPAC: tris[2-(dicyclohexylamino)ethyl] borate.
Chemical Property Profile of 2-(Dicyclohexylamino)-ethanol borate
Property Insights of 2-(Dicyclohexylamino)-ethanol borate
The XLogP value of 9.92 indicates that 2-(Dicyclohexylamino)-ethanol borate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 2-(Dicyclohexylamino)-ethanol borate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dicyclohexylamino)-ethanol borate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Dicyclohexylamino)-ethanol borate?
The CAS number of 2-(Dicyclohexylamino)-ethanol borate is 7539-58-4.
What is the molecular formula of 2-(Dicyclohexylamino)-ethanol borate?
The molecular formula of 2-(Dicyclohexylamino)-ethanol borate is C42H78BN3O3.
What is the molecular weight of 2-(Dicyclohexylamino)-ethanol borate?
The molecular weight of 2-(Dicyclohexylamino)-ethanol borate is 683.61 g/mol.
Where can I buy 2-(Dicyclohexylamino)-ethanol borate?
You can request a quote for 2-(Dicyclohexylamino)-ethanol borate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dicyclohexylamino)-ethanol borate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dicyclohexylamino)-ethanol borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.