beta-Diethylaminoethyl p-(dimethylaminomethyleneamino)benzoate dihydrochloride

[4-[2-(diethylazaniumyl)ethoxycarbonyl]phenyl]iminomethyl-dimethylazanium dichloride

CAS: 2452-58-6

Molecular Formula	`C16H27Cl2N3O2`
Molecular Weight	364.3 g/mol
Topological Polar Surface Area	47.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	363.14804
Heavy Atoms	23
Complexity	319.0

Chemical Identifiers

CAS Number	2452-58-6
SMILES	`CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N=C[NH+](C)C.[Cl-].[Cl-]`
InChIKey	`YNECUNMGIOXHCS-UHFFFAOYSA-N`

📖 Product Overview

beta-Diethylaminoethyl p-(dimethylaminomethyleneamino)benzoate dihydrochloride (CAS: 2452-58-6) is a chemical compound with molecular formula C16H27Cl2N3O2 and molecular weight 364.3 g/mol. Its IUPAC systematic name is [4-[2-(diethylazaniumyl)ethoxycarbonyl]phenyl]iminomethyl-dimethylazanium dichloride. Topological Polar Surface Area 47.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 9 Exact Mass 363.14804 Heavy Atoms 23 Complexity 319.0 InChI Key: YNECUNMGIOXHCS-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N=C[NH+](C)C.[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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