BENZOIC ACID, 3-(2-(1-ETHYLPROPYL)PIPERIDINO)PROPYL ESTER, HYDROCHLORIDE

3-(2-pentan-3-ylpiperidin-1-ium-1-yl)propyl benzoate chloride

CAS: 67049-66-5

Molecular Formula	`C20H32ClNO2`
Molecular Weight	353.9 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	9
Exact Mass	353.21216
Heavy Atoms	24
Complexity	335.0

Chemical Identifiers

CAS Number	67049-66-5
SMILES	`CCC(CC)C1CCCC[NH+]1CCCOC(=O)C2=CC=CC=C2.[Cl-]`
InChIKey	`IXQHVQFLGPVDKI-UHFFFAOYSA-N`

📖 Product Overview

BENZOIC ACID, 3-(2-(1-ETHYLPROPYL)PIPERIDINO)PROPYL ESTER, HYDROCHLORIDE (CAS: 67049-66-5) is a chemical compound with molecular formula C20H32ClNO2 and molecular weight 353.9 g/mol. Its IUPAC systematic name is 3-(2-pentan-3-ylpiperidin-1-ium-1-yl)propyl benzoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 9 Exact Mass 353.21216 Heavy Atoms 24 Complexity 335.0 InChI Key: IXQHVQFLGPVDKI-UHFFFAOYSA-N. SMILES: CCC(CC)C1CCCC[NH+]1CCCOC(=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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What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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