RefChem:373511
TL;DR: RefChem:373511 (CAS 28866-60-6) is a chemical compound with molecular formula C21H36I2N2O2 and molecular weight 602.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetyloxy-1,1,3,6-tetramethyl-4-phenylpiperidin-1-ium-3-yl)methyl-trimethylazanium diiodide
Also Known As: 4-Acetoxy-4-phenyl-5-(trimethylammoniomethyl)-1,1,2,5-tetramethyliperidinium, diiodide, Piperidinium, 4-acetoxy-4-phenyl-5-(trimethylammoniomethyl)-1,1,2,5-tetramethyl-, diiodide, (4-acetyloxy-1,1,3,6-tetramethyl-4-phenylpiperidin-1-ium-3-y, (4-acetyloxy-1,1,3,6-tetramethyl-4-phenylpiperidin-1-ium-3-yl)methyl-trimethylazanium diiodide, 4-(Acetyloxy)-1,1,2,5-tetramethyl-4-phenyl-5-[(trimethylazaniumyl)methyl]piperidin-1-ium diiodide
| Molecular Formula | C21H36I2N2O2 |
|---|---|
| Molecular Weight | 602.09 g/mol |
| LogP | -2.9659 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 602.0866 |
| Heavy Atoms | 27 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 28866-60-6 |
|---|---|
| SMILES | CC1CC(C(C[N+]1(C)C)(C)C[N+](C)(C)C)(C2=CC=CC=C2)OC(=O)C.[I-].[I-] |
| InChIKey | IVHSRKJVBWNRHN-UHFFFAOYSA-L |
Product Overview
RefChem:373511 (CAS 28866-60-6), with molecular formula C21H36I2N2O2 and molecular weight 602.09 g/mol. IUPAC: (4-acetyloxy-1,1,3,6-tetramethyl-4-phenylpiperidin-1-ium-3-yl)methyl-trimethylazanium diiodide.
Chemical Property Profile of RefChem:373511
Property Insights of RefChem:373511
The XLogP value of -2.9659 indicates that RefChem:373511 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, RefChem:373511 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:373511 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:373511?
The CAS number of RefChem:373511 is 28866-60-6.
What is the molecular formula of RefChem:373511?
The molecular formula of RefChem:373511 is C21H36I2N2O2.
What is the molecular weight of RefChem:373511?
The molecular weight of RefChem:373511 is 602.09 g/mol.
Where can I buy RefChem:373511?
You can request a quote for RefChem:373511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:373511?
Yes, KEHONG BIO provides custom synthesis services for RefChem:373511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.