ethyl 5-acetyloxy-6-bromo-1-(4-methylphenyl)-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride

CAS: 88461-86-3

Molecular Formula	`C25H28BrClN2O5`
Molecular Weight	551.9 g/mol
Topological Polar Surface Area	71.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	550.08704
Heavy Atoms	34
Complexity	680.0

Chemical Identifiers

CAS Number	88461-86-3
SMILES	`CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)C)C[NH+]4CCOCC4.[Cl-]`
InChIKey	`LAYFBOYKPMCILT-UHFFFAOYSA-N`

📖 Product Overview

ethyl 5-acetyloxy-6-bromo-1-(4-methylphenyl)-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride (CAS: 88461-86-3) is a chemical compound with molecular formula C25H28BrClN2O5 and molecular weight 551.9 g/mol. Its IUPAC systematic name is ethyl 5-acetyloxy-6-bromo-1-(4-methylphenyl)-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride. Topological Polar Surface Area 71.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 550.08704 Heavy Atoms 34 Complexity 680.0 InChI Key: LAYFBOYKPMCILT-UHFFFAOYSA-N. SMILES: CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC(=O)C)Br)C3=CC=C(C=C3)C)C[NH+]4CCOCC4.[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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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for ethyl 5-acetyloxy-6-bromo-1-(4-methylphenyl)-2-(morpholin-4-ium-4-ylmethyl)indole-3-carboxylate chloride.

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