7-chloro-3-(2-piperidin-1-ium-1-ylethyl)-3,4-dihydro-1H-2,3-benzoxazin-3-ium dichloride

CAS: 21977-22-0

Molecular Formula	`C15H23Cl3N2O`
Molecular Weight	353.7 g/mol
Topological Polar Surface Area	18.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	352.0876
Heavy Atoms	21
Complexity	283.0

Chemical Identifiers

CAS Number	21977-22-0
SMILES	`C1CC[NH+](CC1)CC[NH+]2CC3=C(CO2)C=C(C=C3)Cl.[Cl-].[Cl-]`
InChIKey	`GDTRBAWPVCBCJA-UHFFFAOYSA-N`

📖 Product Overview

7-chloro-3-(2-piperidin-1-ium-1-ylethyl)-3,4-dihydro-1H-2,3-benzoxazin-3-ium dichloride (CAS: 21977-22-0) is a chemical compound with molecular formula C15H23Cl3N2O and molecular weight 353.7 g/mol. Its IUPAC systematic name is 7-chloro-3-(2-piperidin-1-ium-1-ylethyl)-3,4-dihydro-1H-2,3-benzoxazin-3-ium dichloride. Topological Polar Surface Area 18.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 352.0876 Heavy Atoms 21 Complexity 283.0 InChI Key: GDTRBAWPVCBCJA-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)CC[NH+]2CC3=C(CO2)C=C(C=C3)Cl.[Cl-].[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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