triethyl-[2-[2-[2-(triethylazaniumyl)ethoxycarbonyl]benzoyl]oxyethyl]azanium diiodide

CAS: 21480-09-1

Molecular Formula	`C24H42I2N2O4`
Molecular Weight	676.4 g/mol
Topological Polar Surface Area	52.6 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	16
Exact Mass	676.1234
Heavy Atoms	32
Complexity	453.0

Chemical Identifiers

CAS Number	21480-09-1
SMILES	`CC[N+](CC)(CC)CCOC(=O)C1=CC=CC=C1C(=O)OCC[N+](CC)(CC)CC.[I-].[I-]`
InChIKey	`BPZBTNRPFXFUQK-UHFFFAOYSA-L`

📖 Product Overview

triethyl-[2-[2-[2-(triethylazaniumyl)ethoxycarbonyl]benzoyl]oxyethyl]azanium diiodide (CAS: 21480-09-1) is a chemical compound with molecular formula C24H42I2N2O4 and molecular weight 676.4 g/mol. Its IUPAC systematic name is triethyl-[2-[2-[2-(triethylazaniumyl)ethoxycarbonyl]benzoyl]oxyethyl]azanium diiodide. Topological Polar Surface Area 52.6 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 16 Exact Mass 676.1234 Heavy Atoms 32 Complexity 453.0 InChI Key: BPZBTNRPFXFUQK-UHFFFAOYSA-L. SMILES: CC[N+](CC)(CC)CCOC(=O)C1=CC=CC=C1C(=O)OCC[N+](CC)(CC)CC.[I-].[I-].

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