Compound C17H26ClNO2

4-(3-methylpiperidin-1-ium-1-yl)butan-2-yl benzoate chloride

CAS: 67032-21-7

Molecular Formula	`C17H26ClNO2`
Molecular Weight	311.8 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	311.1652
Heavy Atoms	21
Complexity	299.0

Chemical Identifiers

CAS Number	67032-21-7
SMILES	`CC1CCC[NH+](C1)CCC(C)OC(=O)C2=CC=CC=C2.[Cl-]`
InChIKey	`WVXXKRODSGHUDL-UHFFFAOYSA-N`

📖 Product Overview

Compound C17H26ClNO2 (CAS: 67032-21-7) is a chemical compound with molecular formula C17H26ClNO2 and molecular weight 311.8 g/mol. Its IUPAC systematic name is 4-(3-methylpiperidin-1-ium-1-yl)butan-2-yl benzoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 311.1652 Heavy Atoms 21 Complexity 299.0 InChI Key: WVXXKRODSGHUDL-UHFFFAOYSA-N. SMILES: CC1CCC[NH+](C1)CCC(C)OC(=O)C2=CC=CC=C2.[Cl-].

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