p-Aminothiobenzoic acid S-(2-(diethylamino)ethyl) ester hydrochloride

2-(4-aminobenzoyl)sulfanylethyl-diethylazanium chloride

CAS: 5967-94-2

Molecular Formula	`C13H21ClN2OS`
Molecular Weight	288.84 g/mol
Topological Polar Surface Area	72.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	288.10632
Heavy Atoms	18
Complexity	223.0

Chemical Identifiers

CAS Number	5967-94-2
SMILES	`CC[NH+](CC)CCSC(=O)C1=CC=C(C=C1)N.[Cl-]`
InChIKey	`UCJCCFMUYGVNNA-UHFFFAOYSA-N`

📖 Product Overview

p-Aminothiobenzoic acid S-(2-(diethylamino)ethyl) ester hydrochloride (CAS: 5967-94-2) is a chemical compound with molecular formula C13H21ClN2OS and molecular weight 288.84 g/mol. Its IUPAC systematic name is 2-(4-aminobenzoyl)sulfanylethyl-diethylazanium chloride. Topological Polar Surface Area 72.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 288.10632 Heavy Atoms 18 Complexity 223.0 InChI Key: UCJCCFMUYGVNNA-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CCSC(=O)C1=CC=C(C=C1)N.[Cl-].

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