3638 CT

(4-methoxyphenyl)-[3-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]methanone chloride

CAS: 100088-38-8

Molecular Formula	`C22H26ClNO4`
Molecular Weight	403.9 g/mol
Topological Polar Surface Area	49.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	403.15503
Heavy Atoms	28
Complexity	485.0

Chemical Identifiers

CAS Number	100088-38-8
SMILES	`COC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)OCC(O3)C[NH+]4CCCCC4.[Cl-]`
InChIKey	`KNNCNPUGDHWFJU-UHFFFAOYSA-N`

📖 Product Overview

3638 CT (CAS: 100088-38-8) is a chemical compound with molecular formula C22H26ClNO4 and molecular weight 403.9 g/mol. Its IUPAC systematic name is (4-methoxyphenyl)-[3-(piperidin-1-ium-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]methanone chloride. Topological Polar Surface Area 49.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 403.15503 Heavy Atoms 28 Complexity 485.0 InChI Key: KNNCNPUGDHWFJU-UHFFFAOYSA-N. SMILES: COC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2)OCC(O3)C[NH+]4CCCCC4.[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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