BENZOIC ACID, 3-(N-BENZYL-N-METHYLAMINO)PROPYL ESTER, HYDROCHLORIDE

3-benzoyloxypropyl-benzyl-methylazanium chloride

CAS: 67031-59-8

Molecular Formula	`C18H22ClNO2`
Molecular Weight	319.8 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	319.1339
Heavy Atoms	22
Complexity	294.0

Chemical Identifiers

CAS Number	67031-59-8
SMILES	`C[NH+](CCCOC(=O)C1=CC=CC=C1)CC2=CC=CC=C2.[Cl-]`
InChIKey	`JZKSYCBYYJTWRA-UHFFFAOYSA-N`

📖 Product Overview

BENZOIC ACID, 3-(N-BENZYL-N-METHYLAMINO)PROPYL ESTER, HYDROCHLORIDE (CAS: 67031-59-8) is a chemical compound with molecular formula C18H22ClNO2 and molecular weight 319.8 g/mol. Its IUPAC systematic name is 3-benzoyloxypropyl-benzyl-methylazanium chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 319.1339 Heavy Atoms 22 Complexity 294.0 InChI Key: JZKSYCBYYJTWRA-UHFFFAOYSA-N. SMILES: C[NH+](CCCOC(=O)C1=CC=CC=C1)CC2=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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