diethyl-[2-[[2-(2-methoxyanilino)-2-oxoethyl]-methylazaniumyl]ethyl]azanium dichloride

CAS: 77791-67-4

Molecular Formula	`C16H29Cl2N3O2`
Molecular Weight	366.3 g/mol
Topological Polar Surface Area	47.2 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	365.1637
Heavy Atoms	23
Complexity	295.0

Chemical Identifiers

CAS Number	77791-67-4
SMILES	`CC[NH+](CC)CC[NH+](C)CC(=O)NC1=CC=CC=C1OC.[Cl-].[Cl-]`
InChIKey	`XGBPUJDXZJTCIS-UHFFFAOYSA-N`

📖 Product Overview

diethyl-[2-[[2-(2-methoxyanilino)-2-oxoethyl]-methylazaniumyl]ethyl]azanium dichloride (CAS: 77791-67-4) is a chemical compound with molecular formula C16H29Cl2N3O2 and molecular weight 366.3 g/mol. Its IUPAC systematic name is diethyl-[2-[[2-(2-methoxyanilino)-2-oxoethyl]-methylazaniumyl]ethyl]azanium dichloride. Topological Polar Surface Area 47.2 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 365.1637 Heavy Atoms 23 Complexity 295.0 InChI Key: XGBPUJDXZJTCIS-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CC[NH+](C)CC(=O)NC1=CC=CC=C1OC.[Cl-].[Cl-].

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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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📚 Academic Support

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