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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP101363

Benzethonium Chloride

Formula: C27H42ClNO2  |  Mol. Weight: 448.10 g/mol

IUPAC: benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride

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Overview

Molecular Formula C27H42ClNO2
Molecular Weight 448.10 g/mol
Canonical SMILES CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations