[3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide

CAS: 73680-83-8

Molecular Formula	`C14H21IN2O4`
Molecular Weight	408.23 g/mol
Topological Polar Surface Area	75.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	408.0546
Heavy Atoms	21
Complexity	352.0

Chemical Identifiers

CAS Number	73680-83-8
SMILES	`C[N+](C)(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)OC)O.[I-]`
InChIKey	`NKPQWGSBZONPKR-UHFFFAOYSA-N`

📖 Product Overview

[3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide (CAS: 73680-83-8) is a chemical compound with molecular formula C14H21IN2O4 and molecular weight 408.23 g/mol. Its IUPAC systematic name is [3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide. Topological Polar Surface Area 75.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 408.0546 Heavy Atoms 21 Complexity 352.0 InChI Key: NKPQWGSBZONPKR-UHFFFAOYSA-N. SMILES: C[N+](C)(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)OC)O.[I-].

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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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