DTXSID90985933

2-piperidin-1-ium-2-ylethyl benzoate chloride

CAS: 67031-71-4

Molecular Formula	`C14H20ClNO2`
Molecular Weight	269.77 g/mol
Topological Polar Surface Area	42.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	269.11826
Heavy Atoms	18
Complexity	236.0

Chemical Identifiers

CAS Number	67031-71-4
SMILES	`C1CC[NH2+]C(C1)CCOC(=O)C2=CC=CC=C2.[Cl-]`
InChIKey	`LXTGNRBHOWNQBZ-UHFFFAOYSA-N`

📖 Product Overview

DTXSID90985933 (CAS: 67031-71-4) is a chemical compound with molecular formula C14H20ClNO2 and molecular weight 269.77 g/mol. Its IUPAC systematic name is 2-piperidin-1-ium-2-ylethyl benzoate chloride. Topological Polar Surface Area 42.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 269.11826 Heavy Atoms 18 Complexity 236.0 InChI Key: LXTGNRBHOWNQBZ-UHFFFAOYSA-N. SMILES: C1CC[NH2+]C(C1)CCOC(=O)C2=CC=CC=C2.[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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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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