p-Ethoxythiobenzoic acid O-2-morpholinoethyl ester hydrochloride

O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride

CAS: 16780-08-8

Molecular Formula	`C15H22ClNO3S`
Molecular Weight	331.9 g/mol
Topological Polar Surface Area	64.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	331.1009
Heavy Atoms	21
Complexity	287.0

Chemical Identifiers

CAS Number	16780-08-8
SMILES	`CCOC1=CC=C(C=C1)C(=S)OCC[NH+]2CCOCC2.[Cl-]`
InChIKey	`VMMXEXDKYRUNJS-UHFFFAOYSA-N`

📖 Product Overview

p-Ethoxythiobenzoic acid O-2-morpholinoethyl ester hydrochloride (CAS: 16780-08-8) is a chemical compound with molecular formula C15H22ClNO3S and molecular weight 331.9 g/mol. Its IUPAC systematic name is O-(2-morpholin-4-ium-4-ylethyl) 4-ethoxybenzenecarbothioate chloride. Topological Polar Surface Area 64.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 7 Exact Mass 331.1009 Heavy Atoms 21 Complexity 287.0 InChI Key: VMMXEXDKYRUNJS-UHFFFAOYSA-N. SMILES: CCOC1=CC=C(C=C1)C(=S)OCC[NH+]2CCOCC2.[Cl-].

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