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

TL;DR: Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide (CAS 100916-86-7) is a chemical compound with molecular formula C21H40I2N2 and molecular weight 574.1281 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-methyl-1-[5-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)pentyl]-1-azoniabicyclo[2.2.2]octane diiodide

Also Known As: Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide, 1,1'-Pentamethylenebis(3-methylquinuclidinium iodide), 1,1'-(Pentane-1,5-diyl)bis(3-methyl-1-azabicyclo[2.2.2]octan-1-ium) diiodide, 3-methyl-1-[5-(3-methyl-1-azoniabicyclo[2.2.2]octan-1-yl)pentyl]-1-azoniabicyclo[2.2.2]octane diiodide

CAS Number
100916-86-7
Molecular Formula
C21H40I2N2
Molecular Weight
574.1281 g/mol
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Technical Specifications

Molecular FormulaC21H40I2N2
Molecular Weight574.1281 g/mol
XLogP-2.0823
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass574.1281 Da
Heavy Atoms25
Complexity364.0
SMILESCC1C[N+]2(CCC1CC2)CCCCC[N+]34CCC(CC3)C(C4)C.[I-].[I-]
InChIKeyIOGZVIKCTSQJSM-UHFFFAOYSA-L

Product Description

Applications: Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide (CAS 100916-86-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide (CAS 100916-86-7) is a fine chemical with the molecular formula C21H40I2N2 and a molecular weight of 574.13 g/mol. It is also known as Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide and 1,1'-Pentamethylenebis(3-methylquinuclidinium iodide).

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'-pentamethylenebis(3-methyl-, diiodide

XLogP
-2.0823
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
25
Complexity
364.0
Exact Mass
574.1281
Monoisotopic Mass
574.1281
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'-pentamethylenebis(3-methyl-, diiodide

The XLogP value of -2.0823 indicates that Quinuclidinium, 1,1'-pentamethylenebis(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'-pentamethylenebis(3-methyl-, diiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidinium, 1,1'-pentamethylenebis(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'-pentamethylenebis(3-methyl-, diiodide?

The CAS number of Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide is 100916-86-7.

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

The molecular formula of Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide is C21H40I2N2.

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

The molecular weight of Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide is 574.1281 g/mol.

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

Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Quinuclidinium, 1,1'-pentamethylenebis(3-methyl-, diiodide (CAS 100916-86-7) with custom...

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

You can request a quote for Quinuclidinium, 1,1'-pentamethylenebis(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'-pentamethylenebis(3-methyl-, diiodide?

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

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