Phenoxyacetic acid alpha-((isopropylmethylamino)methyl)benzyl ester hydrochloride

methyl-[2-(2-phenoxyacetyl)oxy-2-phenylethyl]-propan-2-ylazanium chloride

CAS: 94912-15-9

Molecular Formula	`C20H26ClNO3`
Molecular Weight	363.9 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	363.16013
Heavy Atoms	25
Complexity	360.0

Chemical Identifiers

CAS Number	94912-15-9
SMILES	`CC(C)[NH+](C)CC(C1=CC=CC=C1)OC(=O)COC2=CC=CC=C2.[Cl-]`
InChIKey	`OIBKODGQDGGHIP-UHFFFAOYSA-N`

📖 Product Overview

Phenoxyacetic acid alpha-((isopropylmethylamino)methyl)benzyl ester hydrochloride (CAS: 94912-15-9) is a chemical compound with molecular formula C20H26ClNO3 and molecular weight 363.9 g/mol. Its IUPAC systematic name is methyl-[2-(2-phenoxyacetyl)oxy-2-phenylethyl]-propan-2-ylazanium chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 363.16013 Heavy Atoms 25 Complexity 360.0 InChI Key: OIBKODGQDGGHIP-UHFFFAOYSA-N. SMILES: CC(C)[NH+](C)CC(C1=CC=CC=C1)OC(=O)COC2=CC=CC=C2.[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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