Compound C17H26ClNO2S

3-(2,6-dimethylpiperidin-1-ium-1-yl)propyl 2-sulfanylbenzoate chloride

CAS: 66591-55-7

Molecular Formula	`C17H26ClNO2S`
Molecular Weight	343.9 g/mol
Topological Polar Surface Area	31.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	343.13727
Heavy Atoms	22
Complexity	327.0

Chemical Identifiers

CAS Number	66591-55-7
SMILES	`CC1CCCC([NH+]1CCCOC(=O)C2=CC=CC=C2S)C.[Cl-]`
InChIKey	`RAOMCFZAXRPCNG-UHFFFAOYSA-N`

📖 Product Overview

Compound C17H26ClNO2S (CAS: 66591-55-7) is a chemical compound with molecular formula C17H26ClNO2S and molecular weight 343.9 g/mol. Its IUPAC systematic name is 3-(2,6-dimethylpiperidin-1-ium-1-yl)propyl 2-sulfanylbenzoate chloride. Topological Polar Surface Area 31.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 343.13727 Heavy Atoms 22 Complexity 327.0 InChI Key: RAOMCFZAXRPCNG-UHFFFAOYSA-N. SMILES: CC1CCCC([NH+]1CCCOC(=O)C2=CC=CC=C2S)C.[Cl-].

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