RefChem:1087566
TL;DR: RefChem:1087566 (CAS 6309-71-3) is a chemical compound with molecular formula C17H32I2N2O and molecular weight 534.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-4-[3-(2-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-ium-2-yl)propyl]morpholin-4-ium diiodide
Also Known As: 2-Methyl-2-(3-(4-methyl-4-morpholinio)propyl)-3a,4,7,7a-tetrahydroisoindolinium diiodide, Isoindolinium, 3a,4,7,7a-tetrahydro-2-methyl-2-(3-(4-methyl-4-morpholinio)propyl)-, diiodide, 8-(N-Methylmorpholiniumpropyl)-8-methyl-8-azoniumbicyclo-(4.3.0)-nonene-2 diiodide, 4-methyl-4-[3-(2-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-iu, Isoindolinium, 3a,4,7,7a-tetrahydro-2-methyl-2-[3-(4-methylmorpholinio)propyl]-, diiodide
| Molecular Formula | C17H32I2N2O |
|---|---|
| Molecular Weight | 534.06 g/mol |
| LogP | -4.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 534.0604 |
| Heavy Atoms | 22 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 6309-71-3 |
|---|---|
| SMILES | C[N+]1(CCOCC1)CCC[N+]2(CC3CC=CCC3C2)C.[I-].[I-] |
| InChIKey | OEHNXJQKRSDFFA-UHFFFAOYSA-L |
Product Overview
RefChem:1087566 (CAS 6309-71-3), with molecular formula C17H32I2N2O and molecular weight 534.06 g/mol. IUPAC: 4-methyl-4-[3-(2-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-ium-2-yl)propyl]morpholin-4-ium diiodide.
Chemical Property Profile of RefChem:1087566
Property Insights of RefChem:1087566
The XLogP value of -4.1 indicates that RefChem:1087566 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, RefChem:1087566 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1087566 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 RefChem:1087566?
The CAS number of RefChem:1087566 is 6309-71-3.
What is the molecular formula of RefChem:1087566?
The molecular formula of RefChem:1087566 is C17H32I2N2O.
What is the molecular weight of RefChem:1087566?
The molecular weight of RefChem:1087566 is 534.06 g/mol.
Where can I buy RefChem:1087566?
You can request a quote for RefChem:1087566 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1087566?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1087566 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.