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Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide structure
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Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide

TL;DR: Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide (CAS 101317-80-0) is a chemical compound with molecular formula C23H44I2N2 and molecular weight 602.15936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-methyl-1-[7-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane diiodide

Also Known As: 1,1'-Heptamethylenebis(3-methylquinuclidinium iodide), Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide, 1,1'-(Heptane-1,7-diyl)bis(3-methyl-1-azabicyclo[2.2.2]octan-1-ium) diiodide, 3-methyl-1-[7-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane diiodide, 3-methyl-1-[7-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)heptyl]-1-azoniabicyclo[2.2.2]octane,diiodide

CAS Number
101317-80-0
Molecular Formula
C23H44I2N2
Molecular Weight
602.15936 g/mol
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Technical Specifications

Molecular FormulaC23H44I2N2
Molecular Weight602.15936 g/mol
XLogP-1.3021
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds8
Exact Mass602.15936 Da
Heavy Atoms27
Complexity389.0
SMILESCC1C[N+]2(CCC1CC2)CCCCCCC[N+]34CCC(CC3)C(C4)C.[I-].[I-]
InChIKeyACUWFFIUAYKRMA-UHFFFAOYSA-L

Product Description

Applications: Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide (CAS 101317-80-0) is a fine chemical with the molecular formula C23H44I2N2 and a molecular weight of 602.16 g/mol. Synonyms include 1,1'-Heptamethylenebis(3-methylquinuclidinium iodide) and Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide

XLogP
-1.3021
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
8
Heavy Atoms
27
Complexity
389.0
Exact Mass
602.15936
Monoisotopic Mass
602.15936
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide

The XLogP value of -1.3021 indicates that Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

The CAS number of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is 101317-80-0.

What is the molecular formula of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

The molecular formula of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is C23H44I2N2.

What is the molecular weight of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

The molecular weight of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is 602.15936 g/mol.

What are the applications of Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...

Where can I buy Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

You can request a quote for Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide?

Yes, CoreyChem provides custom synthesis services for Quinuclidinium, 1,1'-heptamethylenebis(3-methyl-, diiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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