(2-hydroxy-3-morpholin-4-ium-4-ylpropyl) 4-(propylamino)benzoate chloride

CAS: 100482-38-0

Molecular Formula	`C17H27ClN2O4`
Molecular Weight	358.9 g/mol
Topological Polar Surface Area	72.2 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	358.16592
Heavy Atoms	24
Complexity	339.0

Chemical Identifiers

CAS Number	100482-38-0
SMILES	`CCCNC1=CC=C(C=C1)C(=O)OCC(C[NH+]2CCOCC2)O.[Cl-]`
InChIKey	`YNRIQKBNEFWKTM-UHFFFAOYSA-N`

📖 Product Overview

(2-hydroxy-3-morpholin-4-ium-4-ylpropyl) 4-(propylamino)benzoate chloride (CAS: 100482-38-0) is a chemical compound with molecular formula C17H27ClN2O4 and molecular weight 358.9 g/mol. Its IUPAC systematic name is (2-hydroxy-3-morpholin-4-ium-4-ylpropyl) 4-(propylamino)benzoate chloride. Topological Polar Surface Area 72.2 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 9 Exact Mass 358.16592 Heavy Atoms 24 Complexity 339.0 InChI Key: YNRIQKBNEFWKTM-UHFFFAOYSA-N. SMILES: CCCNC1=CC=C(C=C1)C(=O)OCC(C[NH+]2CCOCC2)O.[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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