3-(2-methylpiperidin-1-ium-1-yl)propyl 2-iodobenzoate chloride

CAS: 67032-08-0

Molecular Formula	`C16H23ClINO2`
Molecular Weight	423.71 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	423.0462
Heavy Atoms	21
Complexity	311.0

Chemical Identifiers

CAS Number	67032-08-0
SMILES	`CC1CCCC[NH+]1CCCOC(=O)C2=CC=CC=C2I.[Cl-]`
InChIKey	`WUJRYZYTQDVBBX-UHFFFAOYSA-N`

📖 Product Overview

3-(2-methylpiperidin-1-ium-1-yl)propyl 2-iodobenzoate chloride (CAS: 67032-08-0) is a chemical compound with molecular formula C16H23ClINO2 and molecular weight 423.71 g/mol. Its IUPAC systematic name is 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-iodobenzoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 423.0462 Heavy Atoms 21 Complexity 311.0 InChI Key: WUJRYZYTQDVBBX-UHFFFAOYSA-N. SMILES: CC1CCCC[NH+]1CCCOC(=O)C2=CC=CC=C2I.[Cl-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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