Echinatine, N-oxide

(7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate

CAS: 20267-93-0

Molecular Formula	`C15H25NO6`
Molecular Weight	315.36 g/mol
LogP	-1.0
Topological Polar Surface Area	105.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	315.16818
Heavy Atoms	22
Complexity	479.0

Chemical Identifiers

CAS Number	20267-93-0
SMILES	`CC(C)C(C(C)O)(C(=O)OCC1=CC[N+]2(C1C(CC2)O)[O-])O`
InChIKey	`DNAWGBOKUFFVMB-UHFFFAOYSA-N`

📖 Product Overview

Echinatine, N-oxide (CAS: 20267-93-0) is a chemical compound with molecular formula C15H25NO6 and molecular weight 315.36 g/mol. Its IUPAC systematic name is (7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate. LogP -1.0 Topological Polar Surface Area 105.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 315.16818 Heavy Atoms 22 Complexity 479.0 InChI Key: DNAWGBOKUFFVMB-UHFFFAOYSA-N. SMILES: CC(C)C(C(C)O)(C(=O)OCC1=CC[N+]2(C1C(CC2)O)[O-])O.

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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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