dimethyl-[2-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethoxy]ethyl]azanium2-hydroxy-2-oxoacetate

dimethyl-[2-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethoxy]ethyl]azanium;2-hydroxy-2-oxoacetate

CAS: 807-97-6

Molecular Formula	`C22H26F3NO6`
Molecular Weight	457.4 g/mol
Topological Polar Surface Area	100.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	9
Exact Mass	457.17123
Heavy Atoms	32
Complexity	462.0

Chemical Identifiers

CAS Number	807-97-6
SMILES	`C[NH+](C)CCOCCOC(C1=CC=CC=C1)C2=CC=CC=C2C(F)(F)F.C(=O)(C(=O)[O-])O`
InChIKey	`CSDQSEVMIRYODQ-UHFFFAOYSA-N`

📖 Product Overview

dimethyl-[2-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethoxy]ethyl]azanium2-hydroxy-2-oxoacetate (CAS: 807-97-6) is a chemical compound with molecular formula C22H26F3NO6 and molecular weight 457.4 g/mol. Its IUPAC systematic name is dimethyl-[2-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethoxy]ethyl]azanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 100.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 9 Rotatable Bonds 9 Exact Mass 457.17123 Heavy Atoms 32 Complexity 462.0 InChI Key: CSDQSEVMIRYODQ-UHFFFAOYSA-N. SMILES: C[NH+](C)CCOCCOC(C1=CC=CC=C1)C2=CC=CC=C2C(F)(F)F.C(=O)(C(=O)[O-])O.

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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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