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

CAS: 97157-06-7

Molecular Formula	`C27H30ClNO3`
Molecular Weight	452.0 g/mol
Topological Polar Surface Area	51.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	451.1914
Heavy Atoms	32
Complexity	523.0

Chemical Identifiers

CAS Number	97157-06-7
SMILES	`C1CC[NH+](CC1)CC(C2=CC=CC=C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-]`
InChIKey	`QSUUPFLPJAKAJA-UHFFFAOYSA-N`

📖 Product Overview

(1-phenyl-2-piperidin-1-ium-1-ylethyl) 2-hydroxy-2,2-diphenylacetate chloride (CAS: 97157-06-7) is a chemical compound with molecular formula C27H30ClNO3 and molecular weight 452.0 g/mol. Its IUPAC systematic name is (1-phenyl-2-piperidin-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 451.1914 Heavy Atoms 32 Complexity 523.0 InChI Key: QSUUPFLPJAKAJA-UHFFFAOYSA-N. SMILES: C1CC[NH+](CC1)CC(C2=CC=CC=C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-].

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