Cepacaine structure

Cepacaine

2-butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide;ethyl 4-aminobenzoate;1-hexadecylpyridin-1-ium;chloride;hydrochloride

Also Known As: Cepacaine|2-butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide;ethyl 4-aminobenzoate;1-hexadecylpyridin-1-ium;chloride;hydrochloride|Pyridinium, 1-hexadecyl-, chloride, mixt. with 2-butoxy-N-(2-(diethylamino)ethyl)-4-quinolinecarboxamide monohydrochloride and ethyl 4-aminobenzoate|1-hexadecyl-pyridinium chloride, mixt. with 2-butoxy-n-(2-(diethylamino)ethyl)-4-quinolinecarboxamide monohydrochloride and ethyl 4-aminobenzoate|2-butoxy-N-(2-diethylaminoethyl)quinoline-4-carboxamide; ethyl 4-aminobenzoate; 1-hexadecylpyridin-1-ium; chloride; hydrochloride

CAS: 75975-62-1
Molecular Formula C50H79Cl2N5O4
Molecular Weight 883.5509 g/mol
LogP 8.812
Topological Polar Surface Area 111.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 8
Rotatable Bonds 28
Exact Mass 883.5509
Monoisotopic Mass 883.5509
Heavy Atoms 61
Complexity 746.0

Chemical Identifiers

CAS Number 75975-62-1
SMILES CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN(CC)CC.CCOC(=O)C1=CC=C(C=C1)N.Cl.[Cl-]
InChIKey RODMTGVAYFKSFW-UHFFFAOYSA-M

Product Overview

Cepacaine (CAS 75975-62-1), with molecular formula C50H79Cl2N5O4 and molecular weight 883.5509 g/mol. IUPAC: 2-butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide;ethyl 4-aminobenzoate;1-hexadecylpyridin-1-ium;chloride;hydrochloride.

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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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