(1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-phenoxyacetate chloride

CAS: 94576-80-4

Molecular Formula	`C20H24ClNO3`
Molecular Weight	361.9 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	361.14447
Heavy Atoms	25
Complexity	369.0

Chemical Identifiers

CAS Number	94576-80-4
SMILES	`C1CC[NH+](C1)CC(C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3.[Cl-]`
InChIKey	`FCOUISAEKDBMMX-UHFFFAOYSA-N`

📖 Product Overview

(1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-phenoxyacetate chloride (CAS: 94576-80-4) is a chemical compound with molecular formula C20H24ClNO3 and molecular weight 361.9 g/mol. Its IUPAC systematic name is (1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-phenoxyacetate chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 361.14447 Heavy Atoms 25 Complexity 369.0 InChI Key: FCOUISAEKDBMMX-UHFFFAOYSA-N. SMILES: C1CC[NH+](C1)CC(C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3.[Cl-].

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