(1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-hydroxy-2,2-diphenylacetate chloride

CAS: 96067-89-9

Molecular Formula	`C26H28ClNO3`
Molecular Weight	438.0 g/mol
Topological Polar Surface Area	51.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	437.17578
Heavy Atoms	31
Complexity	508.0

Chemical Identifiers

CAS Number	96067-89-9
SMILES	`C1CC[NH+](C1)CC(C2=CC=CC=C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-]`
InChIKey	`JZJXNRLNTVBJOU-UHFFFAOYSA-N`

📖 Product Overview

(1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-hydroxy-2,2-diphenylacetate chloride (CAS: 96067-89-9) is a chemical compound with molecular formula C26H28ClNO3 and molecular weight 438.0 g/mol. Its IUPAC systematic name is (1-phenyl-2-pyrrolidin-1-ium-1-ylethyl) 2-hydroxy-2,2-diphenylacetate chloride. Topological Polar Surface Area 51.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 437.17578 Heavy Atoms 31 Complexity 508.0 InChI Key: JZJXNRLNTVBJOU-UHFFFAOYSA-N. SMILES: C1CC[NH+](C1)CC(C2=CC=CC=C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-].

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