[2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium diiodide

CAS: 100468-78-8

Molecular Formula	`C22H40I2N4O2`
Molecular Weight	646.4 g/mol
Topological Polar Surface Area	58.2 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	646.1241
Heavy Atoms	30
Complexity	471.0

Chemical Identifiers

CAS Number	100468-78-8
SMILES	`CC[N+](C)(CC)CC(=O)NC1=CC(=C(C=C1C)C)NC(=O)C[N+](C)(CC)CC.[I-].[I-]`
InChIKey	`MDTCYOQMUABIEZ-UHFFFAOYSA-N`

📖 Product Overview

[2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium diiodide (CAS: 100468-78-8) is a chemical compound with molecular formula C22H40I2N4O2 and molecular weight 646.4 g/mol. Its IUPAC systematic name is [2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium diiodide. Topological Polar Surface Area 58.2 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 646.1241 Heavy Atoms 30 Complexity 471.0 InChI Key: MDTCYOQMUABIEZ-UHFFFAOYSA-N. SMILES: CC[N+](C)(CC)CC(=O)NC1=CC(=C(C=C1C)C)NC(=O)C[N+](C)(CC)CC.[I-].[I-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Frequently Asked Questions

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [2-[5-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-2,4-dimethylanilino]-2-oxoethyl]-diethyl-methylazanium diiodide.

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