Carbanilic acid, 1,1-bis(dimethylaminomethyl)-3-phenylpropyl ester, hydrochloride

[2-[(dimethylamino)methyl]-4-phenyl-2-(phenylcarbamoyloxy)butyl]-dimethylazanium chloride

CAS: 69782-44-1

Molecular Formula	`C22H32ClN3O2`
Molecular Weight	406.0 g/mol
Topological Polar Surface Area	46.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	405.2183
Heavy Atoms	28
Complexity	429.0

Chemical Identifiers

CAS Number	69782-44-1
SMILES	`C[NH+](C)CC(CCC1=CC=CC=C1)(CN(C)C)OC(=O)NC2=CC=CC=C2.[Cl-]`
InChIKey	`GJGJFSCFCXOKAL-UHFFFAOYSA-N`

📖 Product Overview

Carbanilic acid, 1,1-bis(dimethylaminomethyl)-3-phenylpropyl ester, hydrochloride (CAS: 69782-44-1) is a chemical compound with molecular formula C22H32ClN3O2 and molecular weight 406.0 g/mol. Its IUPAC systematic name is [2-[(dimethylamino)methyl]-4-phenyl-2-(phenylcarbamoyloxy)butyl]-dimethylazanium chloride. Topological Polar Surface Area 46.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 405.2183 Heavy Atoms 28 Complexity 429.0 InChI Key: GJGJFSCFCXOKAL-UHFFFAOYSA-N. SMILES: C[NH+](C)CC(CCC1=CC=CC=C1)(CN(C)C)OC(=O)NC2=CC=CC=C2.[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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