2-Methyl-2-(2-morpholinoethyl)-5-nitro-1,3-benzodioxole hydrochloride

4-[2-(2-methyl-5-nitro-1,3-benzodioxol-2-yl)ethyl]morpholin-4-ium chloride

CAS: 52400-79-0

Molecular Formula	`C14H19ClN2O5`
Molecular Weight	330.76 g/mol
Topological Polar Surface Area	78.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	330.09824
Heavy Atoms	22
Complexity	382.0

Chemical Identifiers

CAS Number	52400-79-0
SMILES	`CC1(OC2=C(O1)C=C(C=C2)[N+](=O)[O-])CC[NH+]3CCOCC3.[Cl-]`
InChIKey	`CWDIFCKZWHDKEG-UHFFFAOYSA-N`

📖 Product Overview

2-Methyl-2-(2-morpholinoethyl)-5-nitro-1,3-benzodioxole hydrochloride (CAS: 52400-79-0) is a chemical compound with molecular formula C14H19ClN2O5 and molecular weight 330.76 g/mol. Its IUPAC systematic name is 4-[2-(2-methyl-5-nitro-1,3-benzodioxol-2-yl)ethyl]morpholin-4-ium chloride. Topological Polar Surface Area 78.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 3 Exact Mass 330.09824 Heavy Atoms 22 Complexity 382.0 InChI Key: CWDIFCKZWHDKEG-UHFFFAOYSA-N. SMILES: CC1(OC2=C(O1)C=C(C=C2)[N+](=O)[O-])CC[NH+]3CCOCC3.[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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