4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide
TL;DR: 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide (CAS 125239-74-9) is a chemical compound with molecular formula C26H40I2N2O6 and molecular weight 730.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[25-(trimethylazaniumyl)-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl]azanium diiodide
Also Known As: 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide, Dibenzo(b,k)(1,4,7,10,13,16)hexaoxacyclooctadecin-2,14-diaminium, 6,7,9,10,17,18,20,21-octahydro-N,N,N,N',N',N'-hexamethyl-, diiodide, N~2~,N~2~,N~2~,N~14~,N~14~,N~14~-Hexamethyl-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine-2,14-bis(aminium) diiodide, RefChem:337200
| Molecular Formula | C26H40I2N2O6 |
|---|---|
| Molecular Weight | 730.10 g/mol |
| LogP | -2.6498 |
| Topological Polar Surface Area | 55.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 730.0976 |
| Heavy Atoms | 36 |
| Complexity | 858.12604 |
Chemical Identifiers
| CAS Number | 125239-74-9 |
|---|---|
| SMILES | C[N+](C)(C)C1=CC2=C(C=C1)OCCOCCOC3=C(C=C(C=C3)[N+](C)(C)C)OCCOCCO2.[I-].[I-] |
Product Overview
4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide (CAS 125239-74-9), with molecular formula C26H40I2N2O6 and molecular weight 730.10 g/mol. IUPAC: trimethyl-[25-(trimethylazaniumyl)-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl]azanium diiodide.
Chemical Property Profile of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide
Property Insights of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide
The XLogP value of -2.6498 indicates that 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.38 Ų, 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide 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 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide?
The CAS number of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide is 125239-74-9.
What is the molecular formula of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide?
The molecular formula of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide is C26H40I2N2O6.
What is the molecular weight of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide?
The molecular weight of 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide is 730.10 g/mol.
Where can I buy 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide?
You can request a quote for 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide?
Yes, KEHONG BIO provides custom synthesis services for 4',4''-Bis(trimethylammonium)dibenzo-18-crown-6 diiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.