Benzoic acid, thio-, O-2-piperidinoethyl ester, hydrochloride structure

Benzoic acid, thio-, O-2-piperidinoethyl ester, hydrochloride

O-(2-piperidin-1-ium-1-ylethyl) benzenecarbothioate chloride

Also Known As: AC1Q1SQT|RefChem:327966|AC1L1T2H|Thiobenzoic acid O-2-piperidinoethyl ester hydrochloride|BENZOIC ACID, THIO-, O-2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE|1-{2-[(phenylcarbothioyl)oxy]ethyl}piperidinium chloride|O-(2-piperidin-1-ium-1-ylethyl) benzenecarbothioate chloride

CAS: 109598-25-6
Molecular Formula C14H20ClNOS
Molecular Weight 285.0954 g/mol
LogP -1.55
Topological Polar Surface Area 13.67 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 4
Exact Mass 285.0954
Heavy Atoms 18
Complexity 352.1

Chemical Identifiers

CAS Number 109598-25-6
SMILES C1CC[NH+](CC1)CCOC(=S)C2=CC=CC=C2.[Cl-]

Product Overview

Benzoic acid, thio-, O-2-piperidinoethyl ester, hydrochloride (CAS 109598-25-6), with molecular formula C14H20ClNOS and molecular weight 285.0954 g/mol. IUPAC: O-(2-piperidin-1-ium-1-ylethyl) benzenecarbothioate chloride.

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