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RefChem:286109 structure
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RefChem:286109

TL;DR: RefChem:286109 (CAS 13757-50-1) is a chemical compound with molecular formula C24H46I2N2 and molecular weight 616.17505 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dibutyl-methyl-[4-(4-methyl-4-azoniatricyclo[5.2.2.02,6]undec-8-en-4-yl)butyl]azanium diiodide

Also Known As: 4,7-Ethanoisoindolinium, 3a,4,7,7a-tetrahydro-2-(4-(dibutylmethylammonio)butyl)-2-methyl-, diiodide, 2-{4-[Dibutyl(methyl)azaniumyl]butyl}-2-methyl-2,3,3a,4,7,7a-hexahydro-1H-4,7-ethanoisoindol-2-ium diiodide

CAS Number
13757-50-1
Molecular Formula
C24H46I2N2
Molecular Weight
616.17505 g/mol
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Technical Specifications

Molecular FormulaC24H46I2N2
Molecular Weight616.17505 g/mol
XLogP-0.89
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds11
Exact Mass616.17505 Da
Heavy Atoms28
Complexity439.0
SMILESCCCC[N+](C)(CCCC)CCCC[N+]1(CC2C3CCC(C2C1)C=C3)C.[I-].[I-]
InChIKeyYDQCWPZEGMANBS-UHFFFAOYSA-L

Chemical Property Profile of RefChem:286109

XLogP
-0.89
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
11
Heavy Atoms
28
Complexity
439.0
Exact Mass
616.17505
Monoisotopic Mass
616.17505
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 RefChem:286109

The XLogP value of -0.89 indicates that RefChem:286109 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, RefChem:286109 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:286109 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 RefChem:286109?

The CAS number of RefChem:286109 is 13757-50-1.

What is the molecular formula of RefChem:286109?

The molecular formula of RefChem:286109 is C24H46I2N2.

What is the molecular weight of RefChem:286109?

The molecular weight of RefChem:286109 is 616.17505 g/mol.

Where can I buy RefChem:286109?

You can request a quote for RefChem:286109 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:286109?

Yes, CoreyChem provides custom synthesis services for RefChem:286109 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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